butyl 3-hydroxy-3-methyl-5-(2,6,6-trimethyl-2-cyclohexen-1-yl)pent-4-en-1-oate (CAS 72727-71-0) — formula C19H32O3, molecular weight 308.5; category organic chemicals.
| CAS Number | 72727-71-0 |
|---|---|
| Molecular Formula | C19H32O3 |
| Molecular Weight | 308.5 |
| LogP | 3.9 |
| Applications | General Manufacturing Information: 4-Pentenoic acid, 3-hydroxy-3-methyl-5-(2, 6, 6-trimethyl-2-cyclohexen-1-yl)-, butyl ester: INACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: 4-Pentenoic acid, 3-hydroxy-3-methyl-5-(2, 6, 6-trimethyl-2-cyclohexen-1-yl)-, butyl ester: INACTIVE.
butyl 3-hydroxy-3-methyl-5-(2,6,6-trimethyl-2-cyclohexen-1-yl)pent-4-en-1-oate is a carbon-based organic compound with CAS registry number 72727-71-0 and molecular formula C19H32O3 (molecular weight 308.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 72727-71-0
Its molecular formula C19H32O3 comprises 19 C, 32 H, 3 O atoms.
Also known as: butyl 3-hydroxy-3-methyl-5-(2,6,6-trimethyl-2-cyclohexen-1-yl)pent-4-en-1-oate · 3-羟基-3-甲基-5-(2,6,6-三甲基-2-环己烯-1-基)戊-4-烯-1-酸丁酯
Category: organic chemicals
The CAS registry number of butyl 3-hydroxy-3-methyl-5-(2,6,6-trimethyl-2-cyclohexen-1-yl)pent-4-en-1-oate is 72727-71-0.
Molecular formula C19H32O3, molecular weight 308.5.
It is also registered under: butyl 3-hydroxy-3-methyl-5-(2,6,6-trimethyl-2-cyclohexen-1-yl)pent-4-en-1-oate, 3-羟基-3-甲基-5-(2,6,6-三甲基-2-环己烯-1-基)戊-4-烯-1-酸丁酯.
Recorded applications: General Manufacturing Information: 4-Pentenoic acid, 3-hydroxy-3-methyl-5-(2, 6, 6-trimethyl-2-cyclohexen-1-yl)-, butyl ester: INACTIVE.
Category: Organic Chemicals.
Independent reference data for butyl 3-hydroxy-3-methyl-5-(2,6,6-trimethyl-2-cyclohexen-1-yl)pent-4-en-1-oate (CAS 72727-71-0), compiled from public chemistry databases.
| CAS 号 | 72727-71-0 |
|---|---|
| PubChem CID | 175134 |
| 分子式 | C19H32O3 |
| IUPAC 名称 | butyl 3-hydroxy-3-methyl-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-4-enoate |
| UNII（FDA） | NS00062360 |
| Molecular Weight | 308.5 |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 8 |
| Exact Mass | 308.23514488 |
| Monoisotopic Mass | 308.23514488 |
| Topological Polar Surface Area | 46.5 |
| Heavy Atom Count | 22 |
72727-71-0; 4-Pentenoic acid, 3-hydroxy-3-methyl-5-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, butyl ester; DTXSID40888182; QRQVLSMUEPAWSS-UHFFFAOYSA-N; NS00062360; butyl 3-hydroxy-3-methyl-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-4-enoate
3-羟基-3-甲基-5-(2,6,6-三甲基-2-环己烯-1-基)戊-4-烯-1-酸丁酯 · CAS 72727-71-0 · C19H32O3. UNII NS00062360.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.