2,2,2-trideuterio-1-phenylethanol

Names

[ CAS No. ]:
17537-32-5

[ Name ]:
2,2,2-trideuterio-1-phenylethanol

[Synonym ]:
sec-Phenethyl-|A,|A,|A-d3 alcohol
1-Phenylethanol-2,2,2-d3
MFCD00084168
2,2,2-trideuterio-1-phenyl-ethanol

Chemical & Physical Properties

[ Density]:
1.048 g/mL at 25ºC

[ Boiling Point ]:
204ºC745 mm Hg(lit.)

[ Melting Point ]:
19-20ºC(lit.)

[ Molecular Formula ]:
C8H7D3O

[ Molecular Weight ]:
125.18300

[ Flash Point ]:
185 °F

[ Exact Mass ]:
125.09200

[ PSA ]:
20.23000

[ LogP ]:
1.73990

[ Index of Refraction ]:
n20/D 1.532(lit.)

MSDS

Safety Information

[ Symbol ]:

GHS05, GHS07

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H302-H315-H318

[ Precautionary Statements ]:
P280-P301 + P312 + P330-P305 + P351 + P338 + P310

[ Hazard Codes ]:
Xn: Harmful;

[ Risk Phrases ]:
R20/21/22

[ Safety Phrases ]:
26-28-36/37/39-45

[ RIDADR ]:
UN 2937 6.1/PG 3

Synthetic Route

Precursor & DownStream

Precursor

  • 1-Phenyl(2H3)ethanone
  • Iodomethane-d3
  • Benzaldehyde
  • Acetophenone
  • methyl-d3-magnesium iodide
  • Vinylmagnesium bromide

DownStream

  • [1-Bromo(2,2,2-2H3)ethyl]benzene
  • 1-Phenyl(2H3)ethanone
  • (2,2,2-2H3)Ethylbenzene
  • 2,2-dideuterioethenylbenzene

Related Compounds

  • (2,2,2-trideuterio-1-hydroxy-1-phosphonoethyl)phosphonic acid
  • 2,2,2-trideuterio-1-phenyldiazomethane
  • triplet 2,2,2-trideuterio-1-phenylethylidene
  • azobenzene-d10
  • 2-Hydroxyacetophenone-d7
  • Medetomidine-d3 hydrochloride
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • 2-[(Benzyloxy)carbonyl]-7-oxa-2-azaspiro[4.5]decane-4-carboxylic acid
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • (2r,4s)-5-(2,3-Dihydro-1,4-benzodioxine-2-carbonyl)-5-azaspiro[3.5]nonan-2-amine hydrochloride
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • tert-butyl 3-(6-nitro-1H-1,3-benzodiazol-2-yl)pyrrolidine-1-carboxylate
  • 1-{[(1-Cyanocyclohexyl)(methyl)carbamoyl]methyl}-2-methylpiperidine-2-carboxamide