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201740-95-6

201740-95-6 Structure

201740-95-6 Structure
IdentificationBack Directory
[Name]

BENZYL ALCOHOL (RING-13C6)
[CAS]

201740-95-6
[Synonyms]

Benzyl-13C6 Alcohol
13C6]-Benzyl alcohol
BENZYL ALCOHOL (RING-13C6)
Benzyl alcohol (phenyl-13C6)
Benzyl alcohol-(phenyl-3C6)
Benzyl-13C6 alcohol (ring-13C6)
[Molecular Formula]

C7H8O
[MDL Number]

MFCD00143682
[MOL File]

201740-95-6.mol
[Molecular Weight]

114.19
Chemical PropertiesBack Directory
[Melting point ]

-16--13 °C(lit.)
[Boiling point ]

203-205 °C(lit.)
[density ]

1.102 g/mL at 25 °C
[Fp ]

96 °C
[InChI]

1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2/i1+1,2+1,3+1,4+1,5+1,7+1
[InChIKey]

WVDDGKGOMKODPV-ZXJNGCBISA-N
[SMILES]

OC[13c]1[13cH][13cH][13cH][13cH][13cH]1
[CAS Number Unlabeled]

100-51-6
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H332
[Precautionary statements ]

P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312
[Hazard Codes ]

Xn
[Risk Statements ]

20/22
[Safety Statements ]

26
[WGK Germany ]

1
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Hazard InformationBack Directory
[Uses]

Benzyl alcohol-13C6 is the 13C labeled Benzyl alcohol[1].
[References]

[1] Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216. DOI:10.1177/1060028018797110
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