2-chloro-5-(1H-tetrazol-1-yl)benzoic acid

HCID 1129937
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Basic information

Standard SMILES
O=C(O)c1cc(-n2cnnn2)ccc1Cl
InChIKey
VHQODBRTZLWSNM-UHFFFAOYSA-N
Molecular formula
C8H5ClN4O2
Average molar mass
224.6 g/mol

Names & identifiers

Preferred name
2-chloro-5-(1H-tetrazol-1-yl)benzoic acid
IUPAC
2-chloro-5-(tetrazol-1-yl)benzoic acid

Names & synonyms

2-chloro-5-(1H-tetrazol-1-yl)benzoic acid190270-10-12-chloro-5-(tetrazol-1-yl)benzoic Acid2-chloro-5-(1H-1,2,3,4-tetrazol-1-yl)benzoic acid2-Chloro-5-tetrazol-1-yl-benzoic acid2-chloro-5-(1,2,3,4-tetraazolyl)benzoic acidMFCD03044411Oprea1_870029SCHEMBL4426068VHQODBRTZLWSNM-UHFFFAOYSA-NSBB014370STK503483
Show more names
AKOS0001315312-chloro-5-(1-tetrazolyl)benzoic acidDA-08789VS-03724ST41341062-chloro-5-(1h-tetraazol-1-yl)benzoic acid

Database identifiers

PubChem CID
1129937

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
80.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
15

Related reactions

5 records
New reaction record

Compound notes

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