Product Name

  • Name

    Dimethylbenzylcarbinyl acetate

  • EINECS 205-781-3
  • CAS No. 151-05-3
  • Article Data21
  • CAS DataBase
  • Density 1.002 g/cm3
  • Solubility 774.88mg/L at 20℃
  • Melting Point 31.0 to 35.0 °C
  • Formula C12H16O2
  • Boiling Point 258.2 °C at 760 mmHg
  • Molecular Weight 192.258
  • Flash Point 101.8 °C
  • Transport Information
  • Appearance Colorless and transparent
  • Safety 26-36
  • Risk Codes 36/38
  • Molecular Structure Molecular Structure of 151-05-3 (Dimethylbenzylcarbinyl acetate)
  • Hazard Symbols IrritantXi
  • 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;
  • PSA 26.30000
  • LogP 2.57080

Dimethylbenzylcarbinyl acetate Chemical Properties

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

Dimethylbenzylcarbinyl acetate 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.

Dimethylbenzylcarbinyl acetate Consensus Reports

Reported in EPA TSCA Inventory.

Dimethylbenzylcarbinyl acetate Safety Profile

Safety Information of Dimethylbenzylcarbinyl acetate (CAS NO.151-05-3):
Hazard Codes  XiIrritant
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

Dimethylbenzylcarbinyl acetate 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 .

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