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Structure

Benzoic-2,3,4,5,6-d5acid

CAS
1079-02-3
Catalog Number
ACM1079023
Category
Other Products
Molecular Weight
127.15
Molecular Formula
C7HD5O2

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Specification

Synonyms
Benzoic acid (TN), (2H5)Benzoic acid, Benzoic-d5 acid (phenyl-d5), 217158_ALDRICH, MolPort-003-927-939, Benzoic acid-2,3,4,5,6-d5, CID71603, EINECS 214-089-0, 1079-02-3
IUPAC Name
2,3,4,5,6-pentadeuteriobenzoic acid
Canonical SMILES
C1=CC=C(C=C1)C(=O)O
InChI Key
WPYMKLBDIGXBTP-RALIUCGRSA-N
Boiling Point
249ºC(lit.)
Melting Point
121-125ºC(lit.)
Flash Point
111.4ºC
Density
1.247g/cm³
Appearance
white to light beige fine crystalline powder
EC Number
214-089-0
Exact Mass
127.06800
Hazard Statements
Xn
H-Bond Acceptor
2
H-Bond Donor
1
Safety Description
S22-S26-S36
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