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Structure

2-Chloro-4-[1,2,4]triazol-4-ylbenzoic acid

CAS
842977-29-1
Catalog Number
ACM842977291
Category
Other Products
Molecular Weight
223.62
Molecular Formula
C9H6ClN3O2

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Specification

Synonyms
2-chloro-4-(4H-1,2,4-triazol-4-yl)benzoic acid, 2-Chloro-4-[1,2,4]triazol-4-yl-benzoic acid, SBB012753, 842977-29-1, 2-chloro-4-(1,2,4-triazol-4-yl)benzoic acid, ZERO/004551, AC1MKUII, CTK5F2175, MolPort-002-023-606, STK667535, AKOS000112616, AG-H-36801, MCULE-1001531290, BAS 12766364, ST073754, KB-229538, ST4128404, BB 0261813
IUPAC Name
2-chloro-4-(1,2,4-triazol-4-yl)benzoic acid
Canonical SMILES
C1=CC(=C(C=C1N2C=NN=C2)Cl)C(=O)O
InChI Key
QCFSKUCISZXKOB-UHFFFAOYSA-N
Boiling Point
446.7ºC at 760 mmHg
Flash Point
223.9ºC
Density
1.54g/cm³
Exact Mass
223.01500
H-Bond Acceptor
4
H-Bond Donor
1
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