116570-12-8
2-(1H-TETRAZOL-1-YL)BENZOIC ACID
Name
2-(1H-TETRAZOL-1-YL)BENZOIC ACID
Formula
C8 H6 N4 O2
MolWeight
190.161
1Identification
【Name】
2-(1H-TETRAZOL-1-YL)BENZOIC ACID
【CAS】
【MDL】
MFCD00657953
【English Synonyms】
【Formula】
C8 H6 N4 O2
【MolWeight】
190.161
【Inchi】
InChI=1S/C8H6N4O2/c13-8(14)6-3-1-2-4-7(6)12-5-9-10-11-12/h1-5H,(H,13,14)
【InChIKey】
InChIKey=BHBFPWBHORPKDU-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)C(=O)O)n2cnnn2
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
2-(1H-TETRAZOL-1-YL)BENZOIC ACID.cml
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Catalog No:AB06622 1G
Catalog No:AB06622 5G
Catalog No:AB06622 25G
Catalog No:AB06622 100G
Country/Region:Canada
Business Type:Lab/Research institutions
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Catalog No:116570-12-8 up to kgs
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