AG00IFB6

Name: 3-(3-Fluoro-benzyl)-benzoic acid
Brand: Angene Chemical
SKU: AG00IFB6

886569-96-6 | 3-(3-Fluoro-benzyl)-benzoic acid

AG00IFB6

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CAS Number	886569-96-6
Catalog Number	AG00IFB6(AGN-PC-0HTJB8)
Chemical Name	3-(3-Fluoro-benzyl)-benzoic acid
IUPAC Name	3-[(3-fluorophenyl)methyl]benzoic acid
InChI	InChI=1S/C14H11FO2/c15-13-6-2-4-11(9-13)7-10-3-1-5-12(8-10)14(16)17/h1-6,8-9H,7H2,(H,16,17)
InChI Key	RPTTVZIXRSLVJG-UHFFFAOYSA-N
MDL Number	MFCD23378461
Molecular Formula	C14H11FO2
Molecular Weight	230.2343
SMILES	OC(=O)c1cccc(Cc2cccc(F)c2)c1
Synonyms	3-(3-Fluoro-benzyl)-benzoic acid, 3-(3-fluorobenzyl)benzoic acid, 886569-96-6, SCHEMBL9937934, RPTTVZIXRSLVJG-UHFFFAOYSA-N, MFCD23378461, ZINC91304742, AM805750, Benzoic acid, 3-[(3-fluorophenyl)methyl]-, CS-0038885,

Complexity	267
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	230.074g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	230.238g/mol
Monoisotopic Mass	230.074g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

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