Texanol (CAS 77-68-9) — formula C12H24O3, molecular weight 216.32; category organic chemicals.
| CAS Number | 77-68-9 |
|---|---|
| Molecular Formula | C12H24O3 |
| Molecular Weight | 216.32 |
| Melting Point | -50 °C |
| Boiling Point | 471 °F at 760 mmHg (USCG, 1999) |
| LogP | 3.47 |
| Category | Organic Chemicals |
Texanol is a carbon-based organic compound with CAS registry number 77-68-9 and molecular formula C12H24O3 (molecular weight 216.32), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 77-68-9
Its molecular formula C12H24O3 comprises 12 C, 24 H, 3 O atoms.
Also known as: Texanol · 特克醇
Category: organic chemicals
The CAS registry number of Texanol is 77-68-9.
Molecular formula C12H24O3, molecular weight 216.32.
It is also registered under: Texanol, 特克醇.
Category: Organic Chemicals.
Independent reference data for Texanol (CAS 77-68-9), compiled from public chemistry databases.
| CAS Registry Number | 77-68-9 |
|---|---|
| PubChem CID | 6490 |
| Molecular formula | C12H24O3 |
| IUPAC name | (3-hydroxy-2,2,4-trimethylpentyl) 2-methylpropanoate |
| UNII (FDA) | 9LJI14453C |
| Molecular Weight | 216.32 |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 6 |
| Exact Mass | 216.17254462 |
| Monoisotopic Mass | 216.17254462 |
| Topological Polar Surface Area | 46.5 |
| Heavy Atom Count | 15 |
| Boiling Point | 471 °F at 760 mmHg (USCG, 1999) |
|---|---|
| Boiling Point | 255-260 °C |
| Melting Point | -50 °C |
| Flash Point | 248 °F (USCG, 1999) |
| Flash Point | 120 °C o.c. |
| Vapor Pressure | 0.0097 [mmHg] |
| LogP | 3.47 |
| Autoignition Temperature | 393 °C |
Texanol; 25265-77-4; 2,2,4-Trimethyl-1,3-pentanediol monoisobutyrate; DTXSID5027857; RefChem:897547; DTXCID501778475; NX795; 246-771-9; Chissocizer CS 12; CS 12; ID6ZZH846Y; Isobutyraldehyde Tishchenko trimer; Propanoic acid, 2-methyl-, monoester with 2,2,4-trimethyl-1,3-pentanediol; Propionic acid, 2-methyl-, monoester with 2,2,4-trimethyl-1,3-pentanediol; Trimethyl hydroxypentyl isobutyrate; 77-68-9
| Reported hazard statements | H320, H402 |
|---|
H320: Causes eye irritation [Warning Serious eye damage/eye irritation]
H402: Harmful to aquatic life [Hazardous to the aquatic environment, acute hazard]
Texanol · CAS 77-68-9 · C12H24O3. UNII 9LJI14453C. Boiling Point: 471 °F at 760 mmHg (USCG, 1999); Boiling Point: 255-260 °C; Melting Point: -50 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 特克醇