AG00FFDS

Name: 3-(2,6-difluorophenyl)benzoic Acid
Brand: Angene Chemical
SKU: AG00FFDS

656305-06-5 | 3-(2,6-difluorophenyl)benzoic Acid

AG00FFDS

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CAS Number	656305-06-5
Catalog Number	AG00FFDS(AGN-PC-005TF6)
Chemical Name	3-(2,6-difluorophenyl)benzoic Acid
IUPAC Name	3-(2,6-difluorophenyl)benzoic acid
InChI	InChI=1S/C13H8F2O2/c14-10-5-2-6-11(15)12(10)8-3-1-4-9(7-8)13(16)17/h1-7H,(H,16,17)
InChI Key	ZTPVDMLBKGVDLV-UHFFFAOYSA-N
MDL Number	MFCD11848835
Molecular Formula	C13H8F2O2
Molecular Weight	234.1982
SMILES	OC(C1=CC(C2=C(F)C=CC=C2F)=CC=C1)=O
Synonyms	3-(2,6-difluorophenyl)benzoic Acid, 656305-06-5, 2',6'-Difluoro-[1,1'-biphenyl]-3-carboxylic acid, SCHEMBL410739, CHEMBL331526, CTK5C2938, DTXSID90460937, MFCD11848835, ZINC27195797, AKOS013353356, MCULE-8025787867, NE34916, Z1695906710, 3- benzoicacid, CID11276360,

Complexity	273
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	234.049g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	234.202g/mol
Monoisotopic Mass	234.049g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

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