AG01B91Y

Name: 2-{4-[(dimethylamino)methyl]phenyl}benzoic acid
Brand: Angene Chemical
SKU: AG01B91Y

1159492-96-2 | 2-{4-[(dimethylamino)methyl]phenyl}benzoic acid

AG01B91Y

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CAS Number	1159492-96-2
Catalog Number	AG01B91Y
Chemical Name	2-{4-[(dimethylamino)methyl]phenyl}benzoic acid
IUPAC Name	2-[4-[(dimethylamino)methyl]phenyl]benzoic acid
InChI	InChI=1S/C16H17NO2/c1-17(2)11-12-7-9-13(10-8-12)14-5-3-4-6-15(14)16(18)19/h3-10H,11H2,1-2H3,(H,18,19)
InChI Key	CFEUKVSNERIXTP-UHFFFAOYSA-N
MDL Number	MFCD11932172
Molecular Formula	C16H17NO2
Molecular Weight	255.3117
SMILES	CN(CC1=CC=C(C2=C(C(O)=O)C=CC=C2)C=C1)C
Synonyms	2-{4-[(dimethylamino)methyl]phenyl}benzoic acid, 1159492-96-2, ZINC33427949, AKOS006158471, Z2327039994, 4'-[(dimethylamino)methyl]-[1,1'-biphenyl]-2-carboxylic acid,

Complexity	295
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	255.126g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	255.317g/mol
Monoisotopic Mass	255.126g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

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