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Cas Database |
| Name |
4-Acetoxyphenyl methyl carbinol |
EINECS | N/A |
| CAS No. | 53744-50-6 | Density | 1.139g/cm3 |
| PSA | 46.53000 | LogP | 1.66520 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C10H12 O3 | Boiling Point | 290.4°Cat760mmHg |
| Molecular Weight | 180.203 | Flash Point | 122.4°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by ingestion. Low toxicity by skin contact. A severe skin irritant. When heated to decomposition it emits acrid smoke and irritating vapors. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | Toxic by ingestion. A severe skin irritant. |
| Synonyms |
Benzylalcohol, p-hydroxy-a-methyl-, 4-acetate (6CI); (p-Acetoxyphenyl)methyl carbinol;4-Acetoxyphenylmethylcarbinol |
Article Data | 14 |
4-Acetoxyphenyl methyl carbinol Chemical Properties
Product Name: 4-Acetoxyphenyl methyl carbinol (CAS NO.53744-50-6)
Molecular Formula: C10H12O3
Molecular Weight: 180.22g/mol
Mol File: 53744-50-6.mol
Boiling point: .4 °C at 760 mmHg
Flash Point: 122.4 °C
Density: 1.139 g/cm3
Surface Tension: 41.2 dyne/cm
Enthalpy of Vaporization: 55.95 kJ/mol
Vapour Pressure: 0.000957 mmHg at 25°C
XLogP3-AA: 1.3
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of 4-Acetoxyphenyl methyl carbinol (CAS NO.53744-50-6):
IUPAC Name: [4-(1-Hydroxyethyl)phenyl] acetate
Canonical SMILES: CC(C1=CC=C(C=C1)OC(=O)C)O
InChI: InChI=1S/C10H12O3/c1-7(11)9-3-5-10(6-4-9)13-8(2)12/h3-7,11H,1-2H3
InChIKey: VZOVSXXHXIMTQX-UHFFFAOYSA-N
4-Acetoxyphenyl methyl carbinol Toxicity Data With Reference
| 1. | skn-rbt 500 µL SEV | NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) OTS0536931 . | ||
| 2. | orl-rat LDLo:500 mg/kg | NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) OTS0536931 . | ||
| 3. | skn-rbt LD :>7800 mg/kg | NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) OTS0536931 . |
4-Acetoxyphenyl methyl carbinol Safety Profile
Moderately toxic by ingestion. Low toxicity by skin contact. A severe skin irritant. When heated to decomposition it emits acrid smoke and irritating vapors.
4-Acetoxyphenyl methyl carbinol Specification
4-Acetoxyphenyl methyl carbinol , its CAS NO. is 53744-50-6, the synonyms are (p-Acetoxyphenyl)methyl carbinol ; 1-(4-(Acetyloxy)phenyl)ethanol ; 4-(Acetyloxy)-alpha-methylbenzenemethanol ; Benzyl alcohol, p-hydroxy-alpha-methyl-, 4-acetate (6CI) ; C-909 ; Benzenemethanol, 4-(acetyloxy)-alpha-methyl- .
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