AG01C2Q6

Name: 3-benzylbenzoic acid
Brand: Angene Chemical
SKU: AG01C2Q6

620-54-2 | 3-benzylbenzoic acid

AG01C2Q6

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WARNING This product is not for human or veterinary use.

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CAS Number	620-54-2
Catalog Number	AG01C2Q6(AGN-PC-0L5RDX)
Chemical Name	3-benzylbenzoic acid
IUPAC Name	3-benzylbenzoic acid
InChI	InChI=1S/C14H12O2/c15-14(16)13-8-4-7-12(10-13)9-11-5-2-1-3-6-11/h1-8,10H,9H2,(H,15,16)
InChI Key	WHUFYYNKCXXKSU-UHFFFAOYSA-N
MDL Number	MFCD01940398
Molecular Formula	C14H12O2
Molecular Weight	212.2439
SMILES	O=C(O)C1=CC=CC(CC2=CC=CC=C2)=C1
Synonyms	3-benzylbenzoic Acid, 620-54-2, 3-Benzyl-benzoic Acid, AC1N46NJ, SCHEMBL1926951, Benzoic acid, 3-(phenylmethyl)-, WHUFYYNKCXXKSU-UHFFFAOYSA-N, ZINC5947249, AKOS026024819, Z1508917031, Benzoicacid,3-(phenylmethyl)-, CID4124553,

Complexity	231
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	212.084g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	212.248g/mol
Monoisotopic Mass	212.084g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.9

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