Dimethylbenzylcarbinyl acetate (151-05-3),Dimethylbenzylcarbinyl acetate (151-05-3) Manufacturers & Suppliers,Synthesis,MSDS

Basic information

Name:
Dimethylbenzylcarbinyl acetate
CAS No.:
151-05-3
Molecular Structure:
Formula:
C₁₂H₁₆O₂
Molecular Weight:
192.26
Synonyms:
Benzeneethanol,a,a-dimethyl-, acetate (9CI);Phenethyl alcohol, a,a-dimethyl-, acetate (6CI,8CI);1,1-Dimethyl-2-phenylethylacetate;2-Methyl-1-phenyl-2-propyl acetate;2-Methyl-1-phenylpropan-2-ylacetate;Benzyldimethylcarbinol acetate;DMBCA;NSC 46123;a,a-Dimethylphenethyl acetate;
EINECS:
205-781-3
Density:
1.002 g/cm³
Boiling Point:
258.2 °C at 760 mmHg
Flash Point:
101.8 °C
Appearance:
Colorless and transparent
Hazard Symbols:
Xi
Risk Codes:
36/38
Safety Description:
26-36 Details

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Chemistry

Product Name: Dimethylbenzylcarbinyl acetate (CAS NO.151-05-3)

Molecular Formula: C₁₂H₁₆O₂
Molecular Weight: 192.26g/mol
Mol File: 151-05-3.mol
EINECS: 205-781-3
Boiling point: 258.2 °C at 760 mmHg
Flash Point: 101.8 °C
Density: 1.002 g/cm³
Refractive index: n20/D 1.4925(lit.)
Index of Refraction: 1.496
Molar Refractivity: 56.07 cm³
Molar Volume: 191.8 cm³
Surface Tension: 33.9 dyne/cm
Enthalpy of Vaporization: 49.58 kJ/mol
Vapour Pressure: 0.0139 mmHg at 25°C
XLogP3-AA: 2.7
H-Bond Donor: 0
H-Bond Acceptor: 2
Structure Descriptors of Dimethylbenzylcarbinyl acetate (CAS NO.151-05-3):
IUPAC Name: (2-methyl-1-phenylpropan-2-yl) acetate
Canonical SMILES: CC(=O)OC(C)(C)CC1=CC=CC=C1
InChI: InChI=1S/C12H16O2/c1-10(13)14-12(2,3)9-11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
InChIKey: FLUWAIIVLCVEKF-UHFFFAOYSA-N
Product Categories: Alphabetical Listings; C-D; Flavors and Fragrances

Toxicity Data With Reference

1.		skn-rbt 500 mg/24H MOD		FCTXAV Food and Cosmetics Toxicology. 12 (1974),533.
2.		orl-rat LD50:3300 mg/kg		FCTXAV Food and Cosmetics Toxicology. 12 (1974),533.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Safety Information of Dimethylbenzylcarbinyl acetate (CAS NO.151-05-3):
Hazard Codes Xi Irritant
Risk Statements 36/38
R36/38:Irritating to eyes and skin.
Safety Statements 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
WGK Germany 2
RTECS SG8100000

Specification

Dimethylbenzylcarbinyl acetate , its CAS NO. is 151-05-3, the synonyms are 1,1-Dimethyl-2-phenylethyl acetate; 2-Benzyl-2-propyl acetate ; alpha,alpha-Dimethylphenethyl acetate ; Benzyldimethylcarbinyl acetat .