AG01BDC0

Name: 6-Fluoro-1H-1,2,3-benzotriazole-4-carboxylic acid
Brand: Angene Chemical
SKU: AG01BDC0

1798688-36-4 | 6-Fluoro-1H-1,2,3-benzotriazole-4-carboxylic acid

AG01BDC0

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CAS Number	1798688-36-4
Catalog Number	AG01BDC0(AGN-PC-0WOURV)
Chemical Name	6-Fluoro-1H-1,2,3-benzotriazole-4-carboxylic acid
IUPAC Name	6-fluoro-2H-benzotriazole-4-carboxylic acid
InChI	InChI=1S/C7H4FN3O2/c8-3-1-4(7(12)13)6-5(2-3)9-11-10-6/h1-2H,(H,12,13)(H,9,10,11)
InChI Key	UWHVJZFOXUBOHX-UHFFFAOYSA-N
MDL Number	MFCD28023595
Molecular Formula	C7H4FN3O2
Molecular Weight	181.1240
SMILES	OC(C1=C2C(NN=N2)=CC(F)=C1)=O
Synonyms	6-fluoro-1H-1,2,3-benzotriazole-4-carboxylic acid, 1798688-36-4, ZINC97053842, AKOS026744018, MCULE-5724895005, Z1837073449,

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

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited