3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (3E)- (CAS 25312-34-9) — formula C13H22O, molecular weight 194.31; category organic chemicals.
| CAS Number | 25312-34-9 |
|---|---|
| Molecular Formula | C13H22O |
| Molecular Weight | 194.31 |
| Boiling Point | 127.00 °C. @ 15.00 mm Hg |
| LogP | 3 |
| Category | Organic Chemicals |
3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (3E)- is a carbon-based organic compound with CAS registry number 25312-34-9 and molecular formula C13H22O (molecular weight 194.31), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 25312-34-9
Its molecular formula C13H22O comprises 13 C, 22 H, 1 O atoms.
Also known as: 3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (3E)- · 3-丁烯-2-醇, 4-(2,6,6-三甲基-2-环己烯-1-基)-, (3E)-
Category: organic chemicals
The CAS registry number of 3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (3E)- is 25312-34-9.
Molecular formula C13H22O, molecular weight 194.31.
It is also registered under: 3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (3E)-, 3-丁烯-2-醇, 4-(2,6,6-三甲基-2-环己烯-1-基)-, (3E)-.
Category: Organic Chemicals.
Independent reference data for 3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (3E)- (CAS 25312-34-9), compiled from public chemistry databases.
| CAS Registry Number | 25312-34-9 |
|---|---|
| PubChem CID | 5363817 |
| Molecular formula | C13H22O |
| IUPAC name | (E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-ol |
| UNII (FDA) | 4QI2W5Y52K |
| FEMA number | 3624 |
| JECFA number | 391 |
| Molecular Weight | 194.31 |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Exact Mass | 194.167065321 |
| Monoisotopic Mass | 194.167065321 |
| Topological Polar Surface Area | 20.2 |
| Heavy Atom Count | 14 |
| Boiling Point | 127.00 °C. @ 15.00 mm Hg |
|---|---|
| Boiling Point | 127 °C (15 mm Hg) |
| Density | 0.917-0.924 |
| Refractive Index | 1.488-1.492 |
alpha-Ionol; 25312-34-9; (E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-ol; alpha-lonol; latilure; FEMA No. 3624; .alpha.-Ionol; Ionol, alpha-; 4-(2,6,6-Trimethyl-2-cyclohexenyl)-3-buten-2-ol; 4-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-3-buten-2-ol; 3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (3E)-; BRN 2327829; 472-78-6; EINECS 246-815-7; 4QI2W5Y52K; AI3-36071
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: ANTIOXIDANT, FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Floral No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 100% (259 / 259) |
| GHS notification summary | 100% (259 / 259) |
|---|
This chemical does not meet GHS hazard criteria for 100% (259 of 259) of all reports.
Reported as not meeting GHS hazard criteria by 259 of 259 companies. For more detailed information, please visit ECHA C&L website.
3-Buten-2-ol, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (3E)- · CAS 25312-34-9 · C13H22O. UNII 4QI2W5Y52K. Boiling Point: 127.00 °C. @ 15.00 mm Hg; Boiling Point: 127 °C (15 mm Hg); Density: 0.917-0.924.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.