ethyl alpha-cyanodecahydro-4,8,8-trimethyl-1,4-methanoazulene-9-propionate (CAS 85099-14-5) — formula C20H31NO2, molecular weight 317.5; category organic chemicals.
| CAS Number | 85099-14-5 |
|---|---|
| Molecular Formula | C20H31NO2 |
| Molecular Weight | 317.5 |
| LogP | 5.7 |
| Category | Organic Chemicals |
ethyl alpha-cyanodecahydro-4,8,8-trimethyl-1,4-methanoazulene-9-propionate is a carbon-based organic compound with CAS registry number 85099-14-5 and molecular formula C20H31NO2 (molecular weight 317.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 85099-14-5
Its molecular formula C20H31NO2 comprises 20 C, 31 H, 1 N, 2 O atoms.
Also known as: ethyl alpha-cyanodecahydro-4,8,8-trimethyl-1,4-methanoazulene-9-propionate · α-氰基十氢-4,8,8-三甲基-1,4-甲甘蓝-9-丙酸乙酯
Category: organic chemicals
The CAS registry number of ethyl alpha-cyanodecahydro-4,8,8-trimethyl-1,4-methanoazulene-9-propionate is 85099-14-5.
Molecular formula C20H31NO2, molecular weight 317.5.
It is also registered under: ethyl alpha-cyanodecahydro-4,8,8-trimethyl-1,4-methanoazulene-9-propionate, α-氰基十氢-4,8,8-三甲基-1,4-甲甘蓝-9-丙酸乙酯.
Category: Organic Chemicals.
Independent reference data for ethyl alpha-cyanodecahydro-4,8,8-trimethyl-1,4-methanoazulene-9-propionate (CAS 85099-14-5), compiled from public chemistry databases.
| CAS 号 | 85099-14-5 |
|---|---|
| PubChem CID | 56842443 |
| 分子式 | C20H31NO2 |
| IUPAC 名称 | ethyl 2-cyano-3-(3,3,7-trimethyl-8-tricyclo[5.4.0.02,9]undecanyl)propanoate |
| UNII（FDA） | NS00058935 |
| Molecular Weight | 317.5 |
|---|---|
| XLogP3 | 5.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 317.235479232 |
| Monoisotopic Mass | 317.235479232 |
| Topological Polar Surface Area | 50.1 |
| Heavy Atom Count | 23 |
85099-14-5; EINECS 285-468-6; Ethyl alpha-cyanodecahydro-4,8,8-trimethyl-1,4-methanoazulene-9-propionate; SCHEMBL2989171; DTXSID701005484; NS00058935; Ethyl 2-cyano-3-(4,8,8-trimethyldecahydro-1,4-methanoazulen-9-yl)propanoate
α-氰基十氢-4,8,8-三甲基-1,4-甲甘蓝-9-丙酸乙酯 · CAS 85099-14-5 · C20H31NO2. UNII NS00058935.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.