![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, H302 picha iliyoonyeshwa picha](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
| Sifa muhimu za mwili | Thamani | Hali |
| Uzito wa Masi | 263.25 | - |
| Hatua ya kuyeyuka (majaribio) | 177.1-178.3 ° C. | - |
| Kiwango cha kuchemsha (kilitabiriwa) | 666.6 ± 55.0 ° C. | Bonyeza: 760 Torr |
| Uzani (uliotabiriwa) | 1.50 ± 0.1 g/cm3 | Temp: 20 ° C; Bonyeza: 760 Torr |
| PKA (alitabiri) | 11.20 ± 0.20 | Templeti nyingi za asidi: 25 ° C. |
Tabasamu za Canonical O = C1c2 = C (C = C3c (= O) CCN13) C (O) (C (= O) OC2) CC
Isomeric Smiles C (C) [C@] 1 (O) C2 = C (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
Ufunguo wa Inchi
IGKWOGMVAOYVSJ-zdusscgksa-n
Majina mengine 5 kwa dutu hii
. 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-trione; (S)-4-Ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10 (4H)-trione
| Mali inapatikana |
| Macho na kutawanya |
| Mafuta |
Macho na kutawanya
| Mali | Thamani | Hali | Chanzo |
| Nguvu ya mzunguko wa macho | +120.6 deg | C: 0.62 g/100ml; Kutengenezea: Chloroform | (1) IC |
| Nguvu ya mzunguko wa macho | +120.57 deg | C: 0.62 g/100ml; Kutengenezea: chloroform; Temp: 20 ° c | (2) IC |
| Nguvu ya mzunguko wa macho | +119.57 deg | C: 1.0 g/100ml; Kutengenezea: chloroform; λ: 589.3 nm; Temp: 25 ° c | (3) CAS |
| Nguvu ya mzunguko wa macho | Digrii +119.57 · ml/g · dm | C: 1.0 g/100ml; Kutengenezea: chloroform; λ: mstari wa sodium D; Temp: 25 ° c | (4) CAS |
| Nguvu ya mzunguko wa macho | +117.6 deg | C: 0.56 g/100ml; Kutengenezea: chloroform; Temp: 23 ° c | (5) IC |
| Nguvu ya mzunguko wa macho | +116.14 digrii · ml/g · dm | C: 1.0 g/100ml; Kutengenezea: chloroform; λ: mstari wa sodium D; Temp: 26 ° c | (4) CAS |
| Nguvu ya mzunguko wa macho | +96 deg | C: 0.40 g/100ml; Temp: 21 ° c | (6) IC |
| Nguvu ya mzunguko wa macho | +77.8 deg | C: 0.62 g/100ml; Kutengenezea: chloroform; λ: 589.3 nm; Temp: 25 ° c | (7) CAS |
(1) Terasawa, Hirofumi; Bulletin ya Kemikali na Madawa, (1989), 37 (12), 3382-5, caplus
(2) Tagawa, Hiroaki; EP220601, A1, 1987, Caplus
(3) Henegar, Kevin E.; Jarida la Kemia ya Kikaboni, (1997), 62 (19), 6588-6597, Caplus
(4) Watanabe, Tatsuya; Kemia - Jarida la Asia, (2013), 8 (3), 630-638, Caplus
(5) Ejima, Akio; Jarida la Jumuiya ya Chemical, Perkin shughuli 1: Kemia ya Kikaboni na Bio-Kikaboni (1972-1999), (1990) (1), 27-31, Caplus
(6) Wani, Mansukh C.; Jarida la Kemia ya Dawa, (1987), 30 (12), 2317-19, Caplus
(7) Kuang, Yun-Yan; Helvetica Chimica Acta, (2010), 93 (10), 2094-2099, Caplus
Mafuta
| Mali | Thamani | Hali | Chanzo | |
| Hatua ya kuyeyuka | 183-185 ° C (DECOMP) | (1) CAS | ||
| Hatua ya kuyeyuka | 177.1-178.3 ° C. | (2) CAS | ||
| Hatua ya kuyeyuka | 176-177 ° C (DECOMP) | (3) IC | ||
| Hatua ya kuyeyuka | 169-170 ° C. | Kutengenezea: | Ethyl acetate | (4) IC |
(1) Kuang, Yun-Yan; Helvetica Chimica Acta, (2010), 93 (10), 2094-2099, Caplus
(2) Henegar, Kevin E.; Jarida la Kemia ya Kikaboni, (1997), 62 (19), 6588-6597, Caplus
(3) Ejima, Akio; Jarida la Jumuiya ya Chemical, Perkin shughuli 1: Kemia ya Kikaboni na Bio-Kikaboni (1972-1999), (1990) (1), 27-31, Caplus
(4) Wani, Mansukh C.; Jarida la Kemia ya Dawa, (1987), 30 (12), 2317-19, Caplus
Spectra inapatikana
1H NMR
Misa
| Mali inapatikana |
| Kibaolojia |
| Kemikali |
| Wiani |
| Lipinski |
| Muundo unaohusiana |
| Mafuta |
Kibaolojia
| Mali | Thamani | Hali | Chanzo |
| Sababu ya bioconcentration | 1.0 | pH 1; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 1.0 | pH 2; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 1.0 | pH 3; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 1.0 | pH 4; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 1.0 | pH 5; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 1.0 | pH 6; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 1.0 | pH 7; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 1.0 | pH 8; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 1.0 | pH 9; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 1.0 | pH 10; Temp: 25 ° c | (1) ACD |
.
Kemikali
| Mali | Thamani | Hali | Chanzo |
| KOC | 7.37 | pH 1; Temp: 25 ° c | (1) ACD |
| KOC | 7.37 | pH 2; Temp: 25 ° c | (1) ACD |
| KOC | 7.37 | pH 3; Temp: 25 ° c | (1) ACD |
| KOC | 7.37 | pH 4; Temp: 25 ° c | (1) ACD |
| KOC | 7.37 | pH 5; Temp: 25 ° c | (1) ACD |
| KOC | 7.37 | pH 6; Temp: 25 ° c | (1) ACD |
| KOC | 7.37 | pH 7; Temp: 25 ° c | (1) ACD |
| Mali | Thamani | Hali | Chanzo |
| KOC | 7.37 | pH 8; Temp: 25 ° c | (1) ACD |
| KOC | 7.33 | pH 9; Temp: 25 ° c | (1) ACD |
| KOC | 6.94 | pH 10; Temp: 25 ° c | (1) ACD |
| logi | -0.94 | pH 1; Temp: 25 ° c | (1) ACD |
| logi | -0.94 | pH 2; Temp: 25 ° c | (1) ACD |
| logi | -0.94 | pH 3; Temp: 25 ° c | (1) ACD |
| logi | -0.94 | pH 4; Temp: 25 ° c | (1) ACD |
| logi | -0.94 | pH 5; Temp: 25 ° c | (1) ACD |
| logi | -0.94 | pH 6; Temp: 25 ° c | (1) ACD |
| logi | -0.94 | pH 7; Temp: 25 ° c | (1) ACD |
| logi | -0.94 | pH 8; Temp: 25 ° c | (1) ACD |
| logi | -0.94 | pH 9; Temp: 25 ° c | (1) ACD |
| logi | -0.96 | pH 10; Temp: 25 ° c | (1) ACD |
| Logp | -0.936 ± 0.842 | Temp: 25 ° c | (1) ACD |
| Umumunyifu wa ndani | 371 g/l | Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 371 g/l | pH 1; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 371 g/l | pH 2; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 371 g/l | pH 3; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 371 g/l | pH 4; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 371 g/l | pH 5; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 371 g/l | pH 6; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 371 g/l | pH 7; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 371 g/l | pH 8; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 371 g/l | pH 9; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 392 g/l | pH 10; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 371 g/l | Maji yasiyokuwa na maji pH 5.53; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa ndani wa molar | 1.41 mol/l | Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 1.41 mol/l | pH 1; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 1.41 mol/l | pH 2; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 1.41 mol/l | pH 3; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 1.41 mol/l | pH 4; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 1.41 mol/l | pH 5; Temp: 25 ° c | (1) ACD |
| Mali | Thamani | Hali | Chanzo | |
| Umumunyifu wa molar | 1.41 mol/l | pH 6; Temp: 25 ° c | (1) ACD | |
| Umumunyifu wa molar | 1.41 mol/l | pH 7; Temp: 25 ° c | (1) ACD | |
| Umumunyifu wa molar | 1.41 mol/l | pH 8; Temp: 25 ° c | (1) ACD | |
| Umumunyifu wa molar | 1.41 mol/l | pH 9; Temp: 25 ° c | (1) ACD | |
| Umumunyifu wa molar | 1.49 mol/l | pH 10; Temp: 25 ° c | (1) ACD | |
| Umumunyifu wa molar | 1.41 mol/l | Maji yasiyokuwa na maji pH 5.53; Temp: 25 ° c | (1) ACD | |
| Uzito wa Masi | 263.25 | |||
| PKA | 11.20 ± 0.20 | Templeti nyingi za asidi: 25 ° C. | (1) ACD | |
| PKA | -2.24 ± 0.40 | Muda wa msingi zaidi: 25 ° C. | (1) ACD | |
| Shinikizo la mvuke | 1.29 x 10-20 | Torr | Temp: 25 ° c | (1) ACD |
.
Wiani
| Mali | Thamani | Hali | Chanzo |
| Wiani | 1.50 ± 0.1 g/cm3 | Temp: 20 ° C; Bonyeza: 760 Torr | (1) ACD |
| Kiasi cha molar | 174.8 ± 5.0 cm3/mol | Temp: 20 ° C; Bonyeza: 760 Torr | (1) ACD |
.
Lipinski
| Mali | Thamani | Hali | Chanzo |
| Vifungo vya mzunguko wa bure | 2 | (1) ACD | |
| Wapokeaji | 6 | (1) ACD | |
| H wafadhili | 1 | (1) ACD | |
| H wafadhili/jumla ya jumla | 7 | (1) ACD | |
| Logp | -0.936 ± 0.842 | Temp: 25 ° c | (1) ACD |
| Uzito wa Masi | 263.25 |
.
Muundo unaohusiana
| Mali | Thamani | Hali | Chanzo |
| Eneo la uso wa polar | 83.9 A2 | (1) ACD | |
.
Mafuta
| Mali | Thamani | Hali | Chanzo |
| Kiwango cha kuchemsha | 666.6 ± 55.0 ° C. | Bonyeza: 760 Torr | (1) ACD |
| Enthalpy ya mvuke | 112.17 ± 6.0 kJ/mol | Bonyeza: 760 Torr | (1) ACD |
| Kiwango cha Flash | 357.0 ± 31.5 ° C. | (1) ACD |
.
Spectra inapatikana
1H NMR
13C NMR
| Nambari | Taarifa ya hatari | Chanzo |
| H319 | Husababisha kuwasha kwa jicho kubwa | Uainishaji wa Wakala wa Kemikali wa Ulaya (ECHA) na Uainishaji wa Uainishaji - Uainishaji ulioarifiwa na Uandishi - Arifa za kawaida, Uainishaji wa Wakala wa Kemikali wa Ulaya (ECHA) |
| H302 | Hatari ikiwa imemezwa | Uainishaji wa Wakala wa Kemikali wa Ulaya (ECHA) na Uainishaji wa Uainishaji - Uainishaji ulioarifiwa na Uandishi - Arifa za kawaida, Uainishaji wa Wakala wa Kemikali wa Ulaya (ECHA) |
Habari ya Biashara ya Siri: Umma
| Visawe vya kisheria | ||
| (S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyranno(3,4-f)indolizine-3,6,10(4H)-trione | - | Mfaransa |
| (S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyranno[3,4-f]indolizine-3,6,10(4H)-trione | - | Mfaransa |
| (S)-4-Ethyl-4-hydroxy-7,8-dihydro-1H-pyrano(3,4-f)indolizin-3,6,10(4H)-trion | - | Kideni, Kijerumani |
| (S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano(3,4-f)indolizine-3,6,10(4H)-trion | - | Kiholanzi |
| (S)-4-Ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizin-3,6,10(4H)-trion | - | Kideni, Kijerumani |
| (S)-4-ethyl-4-hydroxy-7,8-dihydro-1H-pyrano[3,4-f]indolizine-3,6,10(4H)-trion | - | Kiholanzi |
| (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 | - | Kireno, Kihispania |
| (S)-4-etil-4-hidroxi-7,8-dihidro-1H-pirano[3,4-f]indolizina-3,6,10(4H)-triona | - | Kireno, Kihispania |
| (S)-4-etil-4-idrossi-7,8-diidro-1H-pirano(3,4-f)indolizin-3,6,10(4H)-trione | - | Italia |
| (S)-4-etil-4-idrossi-7,8-diidro-1H-pirano[3,4-f]indolizin-3,6,10(4H)-trione | - | Italia |
| (S)-4-etyl-4-hydroxi-7,8-dihydro-1H-pyrano(3,4-f)indolizin-3,6,10(4H)-trion | - | Kiswidi |
| (S)-4-etyl-4-hydroxi-7,8-dihydro-1H-pyrano[3,4-f]indolizin-3,6,10(4H)-trion | - | Kiswidi |
| (S)-4-etyyli-4-hydroksi-7,8-dihydro-1H-pyrano(3,4-f)indolitsiini-3,6,10(4H)-trioni | - | Kifini |
| (S)-4-etyyli-4-hydroksi-7,8-dihydro-1H-pyrano[3,4-f]indolitsiini-3,6,10(4H)-trioni | - | Kifini |
Maelezo ya nchi/orodha za kimataifa na zingine
Msimbo wa Ushuru ulioandaliwa: 293499 Habari ya Nchi/Mkoa inapatikana
Muhtasari wa Jumuiya ya Ulaya
Bendera za EU
Nambari ya Forodha ya EU CN: 29349990
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