![C13H13NO5 1H-Pyrano[3,4-f]indolizine-3,6,10(4H) -trione, 4-ethyl-7,8-dihydro-4- hydroxy-, (4S)- (9CI, ACI) H319, H302](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C13H13NO5 1H-Pyrano[3,4-f]indolizine-3,6,10(4H) -trione, 4-ethyl-7,8-dihydro-4- hydroxy-, (4S)- (9CI, ACI) H319, Sawirka H302](https://cdn.globalso.com/nvchem/C13H13NO5-1H-Pyrano.jpg)
C13H13NO5 1H-Pyrano[3,4-f]indolizine-3,6,10(4H) -trione, 4-ethyl-7,8-dihydro-4- hydroxy-, (4S)- (9CI, ACI) H319, H302
| Qalabka Jidhka ee Furaha ah | Qiimaha | Xaalad |
| Miisaanka Molecular | 263.25 | - |
| Meesha dhalaalaysa (Tijaabo) | 177.1-178.3 °C | - |
| Barta karkarinta (La saadaaliyay) | 666.6±55.0 °C | Riix: 760 Torr |
| Cufnaanta (La saadaaliyay) | 1.50±0.1 g/cm3 | Heerkulka: 20 °C; Riix: 760 Torr |
| pKa (La saadaaliyay) | 11.20±0.20 | Heerkulka ugu acidic badan: 25 °C |
Dhoola caddaynta O=C1C2=C(C=C3C(=O)CCN13)C(O)(C(=O)OC2)CC
Isomeric SMILES C(C)[C@]1(O)C2=C(=O)N3C(=C2)C(=O)CC3)COC1=O
InChi
InChi=1S/C13H13NO5/c1-2-13(18)8-5-9-10(15)3-4-14(9)11(16)7(8)6-19-12(13)17/ h5,18H,2-4,6H2,1H3/t13-/m0/s1
Furaha InChi
IGKWOGMVAOYVSJ-ZDUSSCGKSA-N
5 Magacyo kale oo Walaxdan ah
(4S) -4-Ethyl-7,8-dihydro-4-hydroxy-1H-pyrano [3,4-f] indolizine-3,6,10 (4H) -trione (ACI); 1H-Pyrano [3,4-f] indolizine-3,6,10 (4H)-trione, 4- ethyl-7,8-dihydro-4-hydroxy-, (S)- (ZCI); (4S) -4-Ethyl-4-hydroxy-7,8-dihydro-1H-pyrano [3,4-f] indolizine-3,6,10 (4H) trione; (4S)-4-Ethyl-4-
hydroxy-7,8-dihydro-1H-pyrano [3,4-f] indolizine-3,6,10-trione; (S)-4-Ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10 (4H)-trione
| Guryaha la heli karo |
| Aragga iyo firdhinta |
| kulaylka |
Aragga iyo firdhinta
| Hanti | Qiimaha | Xaalad | Xigasho |
| Awooda Wareega indhaha | + 120.6 digrii | c: 0.62 g/100ml; Walxaha: Chloroform | (1) IC |
| Awooda Wareega indhaha | + 120.57 deg | c: 0.62 g/100ml; Walxaha: Chloroform; Heerkulka: 20 °C | (2) IC |
| Awooda Wareega indhaha | + 119.57 deg | c: 1.0 g/100ml; Walxaha: Chloroform; λ: 589.3 nm; Heerkulka: 25 °C | (3) CAS |
| Awooda Wareega indhaha | +119.57 digrii·ml/g·dm | c: 1.0 g/100ml; Walxaha: Chloroform; λ: Khadka Sodium D; Heerkulka: 25 °C | (4) CAS |
| Awooda Wareega indhaha | + 117.6 deg | c: 0.56 g/100ml; Walxaha: Chloroform; Heerkulka: 23 °C | (5) IC |
| Awooda Wareega indhaha | +116.14 digrii·ml/gdm | c: 1.0 g/100ml; Walxaha: Chloroform; λ: Khadka Sodium D; Heerkulka: 26 °C | (4) CAS |
| Awooda Wareega indhaha | + 96 deg | c: 0.40 g/100ml; Heerkulka: 21 °C | (6) IC |
| Awooda Wareega indhaha | + 77.8 Deg | c: 0.62 g/100ml; Walxaha: Chloroform; λ: 589.3 nm; Heerkulka: 25 °C | (7) CAS |
(1) Terasawa, Hirofumi; Warbixinta Kiimikada & Dawooyinka, (1989), 37 (12), 3382-5, CAplus
(2) Tagawa, Hiroaki; EP220601, A1, 1987, CAplus
(3) Henegar, Kevin E.; Joornaalka Kiimikada Dabiiciga ah, (1997), 62(19), 6588-6597, CAplus
(4) Watanabe, Tatsuya; Chemistry - Joornaal Aasiyaan ah, (2013), 8(3), 630-638, CAplus
(5) Ejima, Akio; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), (1990)(1), 27-31, CAplus
(6) Wani, Mansukh C.; Joornaalka Kiimikada Daawada, (1987), 30 (12), 2317-19, CAplus
(7) Kuang, Yun-Yan; Helvetica Chimica Acta, (2010), 93 (10), 2094-2099, CAplus
kulaylka
| Hanti | Qiimaha | Xaalad | Xigasho | |
| Meesha dhalaalaysa | 183-185 °C (decomp) | (1) CAS | ||
| Meesha dhalaalaysa | 177.1-178.3 °C | (2) CAS | ||
| Meesha dhalaalaysa | 176-177 °C (decomp) | (3) IC | ||
| Meesha dhalaalaysa | 169-170 °C | Miraha: | Ethyl acetate | (4) IC |
(1) Kuang, Yun-Yan; Helvetica Chimica Acta, (2010), 93 (10), 2094-2099, CAplus
(2) Henegar, Kevin E.; Joornaalka Kiimikada Dabiiciga ah, (1997), 62(19), 6588-6597, CAplus
(3) Ejima, Akio; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), (1990)(1), 27-31, CAplus
(4) Wani, Mansukh C.; Joornaalka Kiimikada Daawada, (1987), 30 (12), 2317-19, CAplus
Spectra waa la heli karaa
1H NMR
Mass
| Guryaha la heli karo |
| Nafley |
| Kiimiko |
| Cufnaanta |
| Lipinski |
| Qaab-dhismeedka La Xiriira |
| kulaylka |
Nafley
| Hanti | Qiimaha | Xaalad | Xigasho |
| Qodobka bioconcentration | 1.0 | pH 1; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 1.0 | pH 2; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 1.0 | pH 3; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 1.0 | pH 4; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 1.0 | pH 5; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 1.0 | pH 6; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 1.0 | pH 7; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 1.0 | pH 8; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 1.0 | pH 9; Heerkulka: 25 °C | (1) ACD |
| Qodobka bioconcentration | 1.0 | pH 10; Heerkulka: 25 °C | (1) ACD |
(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Kiimiko
| Hanti | Qiimaha | Xaalad | Xigasho |
| Koc | 7.37 | pH 1; Heerkulka: 25 °C | (1) ACD |
| Koc | 7.37 | pH 2; Heerkulka: 25 °C | (1) ACD |
| Koc | 7.37 | pH 3; Heerkulka: 25 °C | (1) ACD |
| Koc | 7.37 | pH 4; Heerkulka: 25 °C | (1) ACD |
| Koc | 7.37 | pH 5; Heerkulka: 25 °C | (1) ACD |
| Koc | 7.37 | pH 6; Heerkulka: 25 °C | (1) ACD |
| Koc | 7.37 | pH 7; Heerkulka: 25 °C | (1) ACD |
| Hanti | Qiimaha | Xaalad | Xigasho |
| Koc | 7.37 | pH 8; Heerkulka: 25 °C | (1) ACD |
| Koc | 7.33 | pH 9; Heerkulka: 25 °C | (1) ACD |
| Koc | 6.94 | pH 10; Heerkulka: 25 °C | (1) ACD |
| logD | -0.94 | pH 1; Heerkulka: 25 °C | (1) ACD |
| logD | -0.94 | pH 2; Heerkulka: 25 °C | (1) ACD |
| logD | -0.94 | pH 3; Heerkulka: 25 °C | (1) ACD |
| logD | -0.94 | pH 4; Heerkulka: 25 °C | (1) ACD |
| logD | -0.94 | pH 5; Heerkulka: 25 °C | (1) ACD |
| logD | -0.94 | pH 6; Heerkulka: 25 °C | (1) ACD |
| logD | -0.94 | pH 7; Heerkulka: 25 °C | (1) ACD |
| logD | -0.94 | pH 8; Heerkulka: 25 °C | (1) ACD |
| logD | -0.94 | pH 9; Heerkulka: 25 °C | (1) ACD |
| logD | -0.96 | pH 10; Heerkulka: 25 °C | (1) ACD |
| logP | -0.936±0.842 | Heerkulka: 25 °C | (1) ACD |
| Solubility Mass Intrinsic | 371 g/L | Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 371 g/L | pH 1; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 371 g/L | pH 2; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 371 g/L | pH 3; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 371 g/L | pH 4; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 371 g/L | pH 5; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 371 g/L | pH 6; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 371 g/L | pH 7; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 371 g/L | pH 8; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 371 g/L | pH 9; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 392 g/L | pH 10; Heerkulka: 25 °C | (1) ACD |
| Xalka tirada badan | 371 g/L | Biyaha aan la daboolin pH 5.53; Heerkulka: 25 °C | (1) ACD |
| Solubility Intrinsic Molar | 1.41 mol/L | Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 1.41 mol/L | pH 1; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 1.41 mol/L | pH 2; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 1.41 mol/L | pH 3; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 1.41 mol/L | pH 4; Heerkulka: 25 °C | (1) ACD |
| Solubility Molar | 1.41 mol/L | pH 5; Heerkulka: 25 °C | (1) ACD |
| Hanti | Qiimaha | Xaalad | Xigasho | |
| Solubility Molar | 1.41 mol/L | pH 6; Heerkulka: 25 °C | (1) ACD | |
| Solubility Molar | 1.41 mol/L | pH 7; Heerkulka: 25 °C | (1) ACD | |
| Solubility Molar | 1.41 mol/L | pH 8; Heerkulka: 25 °C | (1) ACD | |
| Solubility Molar | 1.41 mol/L | pH 9; Heerkulka: 25 °C | (1) ACD | |
| Solubility Molar | 1.49 mol/L | pH 10; Heerkulka: 25 °C | (1) ACD | |
| Solubility Molar | 1.41 mol/L | Biyaha aan la daboolin pH 5.53; Heerkulka: 25 °C | (1) ACD | |
| Miisaanka Molecular | 263.25 | |||
| pKa | 11.20±0.20 | Heerkulka ugu acidic badan: 25 °C | (1) ACD | |
| pKa | -2.24±0.40 | Heerkulka ugu badan ee aasaasiga ah: 25 °C | (1) ACD | |
| Cadaadis uumiga | 1.29 x 10-20 | Torr | Heerkulka: 25 °C | (1) ACD |
(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Cufnaanta
| Hanti | Qiimaha | Xaalad | Xigasho |
| Cufnaanta | 1.50±0.1 g/cm3 | Heerkulka: 20 °C; Riix: 760 Torr | (1) ACD |
| Mugga Molar | 174.8± 5.0 cm3 / mol | Heerkulka: 20 °C; Riix: 760 Torr | (1) ACD |
(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Lipinski
| Hanti | Qiimaha | Xaalad | Xigasho |
| Boondhigyo si xor ah loo wareejin karo | 2 | (1) ACD | |
| H Aqbalayaasha | 6 | (1) ACD | |
| H Deeq-bixiyayaasha | 1 | (1) ACD | |
| Ku-deeqaha/Aqbalka Wadarta | 7 | (1) ACD | |
| logP | -0.936±0.842 | Heerkulka: 25 °C | (1) ACD |
| Miisaanka Molecular | 263.25 |
(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Qaab-dhismeedka La Xiriira
| Hanti | Qiimaha | Xaalad | Xigasho |
| Aagga dusha sare ee Polar | 83.9 A2 | (1) ACD | |
(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
kulaylka
| Hanti | Qiimaha | Xaalad | Xigasho |
| Barta Karsan | 666.6±55.0 °C | Riix: 760 Torr | (1) ACD |
| Enthalpy of uumiga | 112.17 ± 6.0 kJ/mol | Riix: 760 Torr | (1) ACD |
| Barta Fiishka | 357.0± 31.5 °C | (1) ACD |
(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra waa la heli karaa
1H NMR
13C NMR
| Koodhka | Bayaanka Khatarta | Xigasho |
| H319 | Waxay keentaa cuncun indhaha oo halis ah | Wakaalladda Kiimikada Yurub (ECHA) Kala-saarid&Alaab-qoritaan - Kala-saar Ogeysiis iyo calaamadeyn - ogaysiisyada ugu badan, Kala-soocidda Wakaaladda Kiimikada Yurub |
| H302 | Waxyeelo haddii la liqo | Wakaalladda Kiimikada Yurub (ECHA) Kala-saarid&Alaab-qoritaan - Kala-saar Ogeysiis iyo calaamadeyn - ogaysiisyada ugu badan, Kala-soocidda Wakaaladda Kiimikada Yurub |
Xogta Ganacsiga Qarsoon: Dadweynaha
| Erayada la midka ah ee sharciyeynta | ||
| (S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyranno(3,4-f)indolizine-3,6,10(4H)-trione | - | Faransiis |
| (S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyranno[3,4-f]indolizine-3,6,10(4H)-trione | - | Faransiis |
| (S)-4-Ethyl-4-hydroxy-7,8-dihydro-1H-pyrano(3,4-f)indolizin-3,6,10(4H)-trion | - | Danish, Jarmal |
| (S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano(3,4-f)indolizine-3,6,10(4H)-trion | - | Dutch |
| (S)-4-Ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizin-3,6,10(4H)-trion | - | Danish, Jarmal |
| (S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10(4H)-trion | - | Dutch |
| (S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10(4H)-trione | - | - |
| (S)-4-etil-4-hidroxi-7,8-dihidro-1H-pirano(3,4-f)indolizina-3,6,10(4H)-triona | - | Boortaqiis, Isbaanish |
| (S)-4-etil-4-hidroxi-7,8-dihidro-1H-pirano[3,4-f]indolizina-3,6,10(4H)-triona | - | Boortaqiis, Isbaanish |
| (S)-4-etil-4-idrossi-7,8-diidro-1H-pirano(3,4-f)indolizin-3,6,10(4H)-trione | - | Talyaani |
| (S)-4-etil-4-idrossi-7,8-diidro-1H-pirano[3,4-f]indolizin-3,6,10(4H)-trione | - | Talyaani |
| (S)-4-etyl-4-hydroxi-7,8-dihydro-1H-pyrano(3,4-f)indolizin-3,6,10(4H)-trion | - | Iswidish |
| (S)-4-etyl-4-hydroxi-7,8-dihydro-1H-pyrano[3,4-f]indolizin-3,6,10(4H)-trion | - | Iswidish |
| (S)-4-etyyli-4-hydroksi-7,8-dihydro-1H-pyrano(3,4-f)indolitsiini-3,6,10(4H)-trioni | - | Finnish |
| (S)-4-etyyli-4-hydroksi-7,8-dihydro-1H-pyrano[3,4-f]indolitsiini-3,6,10(4H)-trioni | - | Finnish |
Faahfaahinta Dal/Caalami & Liisyo Kale
Xeerka Tarifka La Iswaafajiyay: 293499 Macluumaadka Dalka/Gobolka La Heli karo
Soo koobida Midowga Yurub
Calanka Midowga Yurub
Xeerka Kastamka Midowga Yurub CN: 29349990
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