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Structure

2-Phenyl-d5-ethanol

CAS
35845-63-7
Catalog Number
ACM35845637
Category
Other Products
Molecular Weight
127.20
Molecular Formula
C8H5D5O

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Specification

Synonyms
Benzeneethanol-D5
IUPAC Name
2-(2,3,4,5,6-pentadeuteriophenyl)ethanol
Canonical SMILES
C1=CC=C(C=C1)CCO
InChI
InChI=1S/C8H10O/c9-7-6-8-4-2-1-3-5-8/h1-5,9H,6-7H2/i1D,2D,3D,4D,5D
InChI Key
WRMNZCZEMHIOCP-RALIUCGRSA-N
Boiling Point
218.199ºC at 760 mmHg
Flash Point
98.432ºC
Density
1.062 g/cm³
Appearance
Clear yellow oil
Chemical Formula
C6D5CH2CH2OH
Exact Mass
127.10500
H-Bond Acceptor
1
H-Bond Donor
1
Isomeric SMILES
[2H]C1=C(C(=C(C(=C1[2H])[2H])CCO)[2H])[2H]
Stability
Stable if stored under recommended conditions. After three years, the compound should be re-analyzed for chemical purity before use.
Storage Conditions
Store at room temperature
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