Home Other Building Blocks 5-FLUORO-1H-BENZO[D][1,2,3]TRIAZOLE-6-CARBOXYLIC ACID

5-FLUORO-1H-BENZO[D][1,2,3]TRIAZOLE-6-CARBOXYLIC ACID

CAS No.:
1427081-62-6
Catalog Number:
AG01DKVX
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01DKVX
Chemical Name:
5-FLUORO-1H-BENZO[D][1,2,3]TRIAZOLE-6-CARBOXYLIC ACID
CAS Number:
1427081-62-6
MDL Number:
MFCD24039216
IUPAC Name:
6-fluoro-2H-benzotriazole-5-carboxylic acid
InChI:
InChI=1S/C7H4FN3O2/c8-4-2-6-5(9-11-10-6)1-3(4)7(12)13/h1-2H,(H,12,13)(H,9,10,11)
InChI Key:
OXEDXRQTZIOASY-UHFFFAOYSA-N
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.029g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
181.126g/mol
Monoisotopic Mass:
181.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties