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Structure

1-Benzyl-5-methyl-1H-[1,2,3]triazole-4-carboxylic acid

CAS
54698-60-1
Catalog Number
ACM54698601
Category
Other Products
Molecular Weight
217.22
Molecular Formula
C11H11N3O2

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Specification

Synonyms
54698-60-1, SBB053301, 1-Benzyl-5-methyl-1H-[1,2,3]triazole-4-carboxylic Acid, 5-methyl-1-benzyl-1,2,3-triazole-4-carboxylic acid, SureCN795210, AC1MDS00, CTK1G9273, MolPort-000-145-270, AKOS004123005, AG-F-90635, MCULE-2094106647, KB-86040, 1-benzyl-5-methyltriazole-4-carboxylic acid, FT-0640269, ST50949640, 1-Benzyl-4-carboxy-5-methyl-1H-1,2,3-triazole, A830328, 5-methyl-1-(phenylmethyl)-4-triazolecarboxylic acid, I04-4142, 1-benzyl-5-methyl-1,2,3-triazole-4-carboxylic acid
IUPAC Name
1-benzyl-5-methyltriazole-4-carboxylic acid
Canonical SMILES
CC1=C(N=NN1CC2=CC=CC=C2)C(=O)O
InChI Key
WIULYDQJIFTHIK-UHFFFAOYSA-N
Boiling Point
455ºC at 760 mmHg
Melting Point
170ºC
Flash Point
228.9ºC
Density
1.3 g/cm³
Exact Mass
217.08500
H-Bond Acceptor
4
H-Bond Donor
1
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