AG01AN53

Name: 4-Cyano-3,5-difluorobenzoic acid
Brand: Angene Chemical
SKU: AG01AN53

1427084-20-5 | 4-Cyano-3,5-difluorobenzoic acid

AG01AN53

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CAS Number	1427084-20-5
Catalog Number	AG01AN53
Chemical Name	4-Cyano-3,5-difluorobenzoic acid
IUPAC Name	4-cyano-3,5-difluorobenzoic acid
InChI	InChI=1S/C8H3F2NO2/c9-6-1-4(8(12)13)2-7(10)5(6)3-11/h1-2H,(H,12,13)
InChI Key	ANKDONHOKXFXPO-UHFFFAOYSA-N
MDL Number	MFCD24038828
Molecular Formula	C8H3F2NO2
Molecular Weight	183.1117
SMILES	OC(C1=CC(F)=C(C#N)C(F)=C1)=O
Synonyms	4-Cyano-3,5-difluorobenzoic acid, 1427084-20-5, MFCD24038828, AKOS027196662, ZINC238646221, Z2235790763,

Complexity	248
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	183.013g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	183.114g/mol
Monoisotopic Mass	183.013g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	61.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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