2-methylpropyl 1-methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylate (CAS 72727-56-1) — formula C18H30O2, molecular weight 278.4; category organic chemicals.
| CAS Number | 72727-56-1 |
|---|---|
| Molecular Formula | C18H30O2 |
| Molecular Weight | 278.4 |
| LogP | 5.1 |
| Applications | General Manufacturing Information: 3-Cyclohexene-1-carboxylic acid, 1-methyl-3-(4-methyl-3-penten-1-yl)-, 2-methylpropyl ester: INACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: 3-Cyclohexene-1-carboxylic acid, 1-methyl-3-(4-methyl-3-penten-1-yl)-, 2-methylpropyl ester: INACTIVE.
2-methylpropyl 1-methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylate is a carbon-based organic compound with CAS registry number 72727-56-1 and molecular formula C18H30O2 (molecular weight 278.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 72727-56-1
Its molecular formula C18H30O2 comprises 18 C, 30 H, 2 O atoms.
Also known as: 2-methylpropyl 1-methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylate · 1-甲基-3-(4-甲基-3-戊烯基)环己-3-烯-1-甲酸2-甲基丙基酯
Category: organic chemicals
The CAS registry number of 2-methylpropyl 1-methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylate is 72727-56-1.
Molecular formula C18H30O2, molecular weight 278.4.
It is also registered under: 2-methylpropyl 1-methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylate, 1-甲基-3-(4-甲基-3-戊烯基)环己-3-烯-1-甲酸2-甲基丙基酯.
Recorded applications: General Manufacturing Information: 3-Cyclohexene-1-carboxylic acid, 1-methyl-3-(4-methyl-3-penten-1-yl)-, 2-methylpropyl ester: INACTIVE.
Category: Organic Chemicals.
Independent reference data for 2-methylpropyl 1-methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylate (CAS 72727-56-1), compiled from public chemistry databases.
| CAS 号 | 72727-56-1 |
|---|---|
| PubChem CID | 175121 |
| 分子式 | C18H30O2 |
| IUPAC 名称 | 2-methylpropyl 1-methyl-3-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylate |
| UNII（FDA） | NS00062564 |
| Molecular Weight | 278.4 |
|---|---|
| XLogP3 | 5.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 7 |
| Exact Mass | 278.224580195 |
| Monoisotopic Mass | 278.224580195 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 20 |
EINECS 276-789-2; DTXSID30888171; 1-Methyl-3-(4-methylpent-3-enyl)cyclohex-3-ene-1-carboxylic acid, 2-methylpropyl ester; 3-Cyclohexene-1-carboxylic acid, 1-methyl-3-(4-methyl-3-penten-1-yl)-, 2-methylpropyl ester; 3-Cyclohexene-1-carboxylic acid, 1-methyl-3-(4-methyl-3-pentenyl)-, 2-methylpropyl ester; RefChem:500750; DTXCID601027453; 72727-56-1; 2-Methylpropyl 1-methyl-3-(4-methyl-3-pentenyl)cyclohex-3-ene-1-carboxylate; MWSFCHQEVONRLO-UHFFFAOYSA-N; 2-METHYLPROPYL 1-METHYL-3-(4-METHYLPENT-3-EN-1-YL)CYCLOHEX-3-ENE-1-CARBOXYLATE; NS00062564
1-甲基-3-(4-甲基-3-戊烯基)环己-3-烯-1-甲酸2-甲基丙基酯 · CAS 72727-56-1 · C18H30O2. UNII NS00062564.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.