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HomeProduct name list2-Methyl-1-phenyl-2-propanol

2-Methyl-1-phenyl-2-propanol

Synonym(s):1,1-Dimethyl-2-phenylethyl alcohol;Benzyl dimethyl carbinol

  • CAS NO.:100-86-7
  • Empirical Formula: C10H14O
  • Molecular Weight: 150.22
  • MDL number: MFCD00004465
  • EINECS: 202-896-0
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-12-18 13:37:16
2-Methyl-1-phenyl-2-propanol Structural

What is 2-Methyl-1-phenyl-2-propanol?

Chemical properties

Clear colorless liquid or low melting solid

Chemical properties

2-Methyl-1-phenyl-2-propanol has not yet been found in nature. The alcohol has a floral, herbaceous odor, reminiscent of lilac, and is prepared by a Grignard reaction of benzylmagnesium chloride and acetone. It is used in perfumery for various flower notes (e.g., lilac, hyacinth, mimosa). The alcohol is stable to alkali and is thus suited for soap perfumes. It is used to prepare a number of esters, which are also used as fragrance substances.

Chemical properties

α,α-Dimethylphenethyl alcohol has a fresh, floral odor and bitter taste.

Occurrence

Reported found in cocoa.

The Uses of 2-Methyl-1-phenyl-2-propanol

2-Methyl-1-phenyl-2-propanol is used in confecting floral essences, such as lily, narcissus, jasmine and keiskei and other advanced floral essences. Its acetic ester has fresh fragrance so that it has especial value.

The Uses of 2-Methyl-1-phenyl-2-propanol

2-Methyl-1-phenyl-2-propanol was used in the preparation of 2-methyl-1-phenyl-2-propyl bromide.

Preparation

From acetone and benzyl magnesium chloride or benzyl magnesium bromide.

Synthesis Reference(s)

Tetrahedron Letters, 27, p. 3129, 1986 DOI: 10.1016/S0040-4039(00)84733-4

Flammability and Explosibility

Not classified

Safety Profile

Moderately toxic by ingestion. Combustible liquid. When heated to decomposition it emits acrid smoke and irritating fumes.

Synthesis

Dimethyl Benzyl Carbinol is obtained by Grignard synthesis from Benzyl-magnesium chloride and Acetone.

Properties of 2-Methyl-1-phenyl-2-propanol

Melting point: 23-25 °C(lit.)
Boiling point: 94-96 °C10 mm Hg(lit.)
Density  0.974 g/mL at 25 °C(lit.)
vapor pressure  1hPa at 25℃
refractive index  n20/D 1.514(lit.)
FEMA  2393 | ALPHA,ALPHA-DIMETHYLPHENETHYL ALCOHOL
Flash point: 178 °F
storage temp.  Sealed in dry,Room Temperature
solubility  Chloroform (Sparingly), DMSO (Sparingly, Heated)
pka 15.31±0.29(Predicted)
form  Oil
color  Colourless
Odor at 100.00 %. clean floral green rose cortex oily rhubarb
Water Solubility  Slightly soluble in water.
JECFA Number 1653
BRN  1855608
CAS DataBase Reference 100-86-7(CAS DataBase Reference)
NIST Chemistry Reference Benzeneethanol, «alpha»,«alpha»-dimethyl-(100-86-7)
EPA Substance Registry System .alpha.,.alpha.-Dimethylbenzeneethanol (100-86-7)

Safety information for 2-Methyl-1-phenyl-2-propanol

Signal word Warning
Pictogram(s)
ghs
Skull and Crossbones
Acute Toxicity
GHS06
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H301:Acute toxicity,oral
H302:Acute toxicity,oral
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P321:Specific treatment (see … on this label).
P405:Store locked up.
P501:Dispose of contents/container to..…

Computed Descriptors for 2-Methyl-1-phenyl-2-propanol

InChIKey RIWRBSMFKVOJMN-UHFFFAOYSA-N

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