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Structure

3-(2H-TETRAZOL-5-YL)-BENZOIC ACID

CAS
73096-39-6
Catalog Number
ACM73096396
Category
Other Products
Molecular Weight
190.16
Molecular Formula
C8H6N4O2

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Specification

Synonyms
ChemDiv2_002738, MolPort-001-002-586, MolPort-001-004-187, NSC338094, HMS1376M10, ZERO/008791, CID333942, STK667431, 3-(2H-Tetrazol-5-yl)-benzoic acid, A3277/0139431, 73096-39-6
IUPAC Name
3-(2H-tetrazol-5-yl)benzoic acid
Canonical SMILES
C1=CC(=CC(=C1)C(=O)O)C2=NNN=N2
InChI Key
MIERACSHCALJOM-UHFFFAOYSA-N
Boiling Point
496.4ºC at 760 mmHg
Melting Point
284-286ºC
Flash Point
254ºC
Density
1.518 g/cm³
Exact Mass
190.04900
H-Bond Acceptor
5
H-Bond Donor
2
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