1-heptadec-8-enyl 23-octadecyl 3-[(heptadec-8-enyloxy)carbonyl]-3,12,21-trihydroxy-8,17-dimethyl-12,21-bis[(octadecyloxy)carbonyl]-5,10,14,19-tetraoxo-6,9,15,18-tetraoxatricosanedioate (CAS 85049-94-1) — formula C112H204O21, molecular weight 1886.8; category organic chemicals.
| CAS Number | 85049-94-1 |
|---|---|
| Molecular Formula | C112H204O21 |
| Molecular Weight | 1886.8 |
| LogP | 38.5 |
| Category | Organic Chemicals |
1-heptadec-8-enyl 23-octadecyl 3-[(heptadec-8-enyloxy)carbonyl]-3,12,21-trihydroxy-8,17-dimethyl-12,21-bis[(octadecyloxy)carbonyl]-5,10,14,19-tetraoxo-6,9,15,18-tetraoxatricosanedioate is a carbon-based organic compound with CAS registry number 85049-94-1 and molecular formula C112H204O21 (molecular weight 1886.8), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 85049-94-1
Its molecular formula C112H204O21 comprises 112 C, 204 H, 21 O atoms.
Also known as: 1-heptadec-8-enyl 23-octadecyl 3-[(heptadec-8-enyloxy)carbonyl]-3,12,21-trihydroxy-8,17-dimethyl-12,21-bis[(octadecyloxy)carbonyl]-5,10,14,19-tetraoxo-6,9,15,18-tetraoxatricosanedioate · 1-十七-8-烯基 23-十八烷基 3-[(十七-8-烯氧基)羰基]-3,12,21-三羟基-8,17-二甲基-12,21-双[(十八烷氧基)羰基]-5,10,14,19-四氧代-6,9,15,18-四氧二十三烷二酸酯
Category: organic chemicals
The CAS registry number of 1-heptadec-8-enyl 23-octadecyl 3-[(heptadec-8-enyloxy)carbonyl]-3,12,21-trihydroxy-8,17-dimethyl-12,21-bis[(octadecyloxy)carbonyl]-5,10,14,19-tetraoxo-6,9,15,18-tetraoxatricosanedioate is 85049-94-1.
Molecular formula C112H204O21, molecular weight 1886.8.
It is also registered under: 1-heptadec-8-enyl 23-octadecyl 3-[(heptadec-8-enyloxy)carbonyl]-3,12,21-trihydroxy-8,17-dimethyl-12,21-bis[(octadecyloxy)carbonyl]-5,10,14,19-tetraoxo-6,9,15,18-tetraoxatricosanedioate, 1-十七-8-烯基 23-十八烷基 3-[(十七-8-烯氧基)羰基]-3,12,21-三羟基-8,17-二甲基-12,21-双[(十八烷氧基)羰基]-5,10,14,19-四氧代-6,9,15,18-四氧二十三烷二酸酯.
Category: Organic Chemicals.
Independent reference data for 1-heptadec-8-enyl 23-octadecyl 3-[(heptadec-8-enyloxy)carbonyl]-3,12,21-trihydroxy-8,17-dimethyl-12,21-bis[(octadecyloxy)carbonyl]-5,10,14,19-tetraoxo-6,9,15,18-tetraoxatricosanedioate (CAS 85049-94-1), compiled from public chemistry databases.
| CAS 号 | 85049-94-1 |
|---|---|
| PubChem CID | 44149299 |
| 分子式 | C112H204O21 |
| IUPAC 名称 | 1-O,2-O-bis[(E)-heptadec-8-enyl] 3-O-[2-[3-hydroxy-5-[2-(3-hydroxy-5-octadecoxy-3-octadecoxycarbonyl-5-oxopentanoyl)oxypropoxy]-3-octadecoxycarbonyl-5-oxopentanoyl]oxypropyl] 2-hydroxypropane-1,2,3-tricarboxylate |
| Molecular Weight | 1886.8 |
|---|---|
| XLogP3 | 38.5 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 21 |
| Rotatable Bond Count | 111 |
| Exact Mass | 1886.49286835 |
| Monoisotopic Mass | 1885.48951351 |
| Topological Polar Surface Area | 297 |
| Heavy Atom Count | 133 |
EINECS 285-267-3; 85049-94-1; DSLLWPUAZZASBV-CIMUWSJMSA-N
1-十七-8-烯基 23-十八烷基 3-[(十七-8-烯氧基)羰基]-3,12,21-三羟基-8,17-二甲基-12,21-双[(十八烷氧基)羰基]-5,10,14,19-四氧代-6,9,15,18-四氧二十三烷二酸酯 · CAS 85049-94-1 · C112H204O21.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.