AG004NW7

Name: 4-{[(3-Methyl-2-thienyl)methyl]amino}benzoic acid
Brand: Angene Chemical
SKU: AG004NW7

869950-51-6 | 4-{[(3-Methyl-2-thienyl)methyl]amino}benzoic acid

AG004NW7

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CAS Number	869950-51-6
Catalog Number	AG004NW7(AGN-PC-0WB543)
Chemical Name	4-{[(3-Methyl-2-thienyl)methyl]amino}benzoic acid
IUPAC Name	4-[(3-methylthiophen-2-yl)methylamino]benzoic acid
InChI	InChI=1S/C13H13NO2S/c1-9-6-7-17-12(9)8-14-11-4-2-10(3-5-11)13(15)16/h2-7,14H,8H2,1H3,(H,15,16)
InChI Key	PVOPXJDFVBSJES-UHFFFAOYSA-N
MDL Number	MFCD07391531
Molecular Formula	C13H13NO2S
Molecular Weight	247.3128
SMILES	C1(CNC2C=CC(=CC=2)C(O)=O)SC=CC=1C
Synonyms	869950-51-6, 4-{[(3-methyl-2-thienyl)methyl]amino}benzoic acid, 4-(((3-Methylthiophen-2-yl)methyl)amino)benzoic acid, 4-{[(3-methylthiophen-2-yl)methyl]amino}benzoic acid, ASN 07017052, AC1O5OAE, CTK5F7557, DTXSID00424585, CHEMBRDG-BB 9071318, ZINC4897211, ZX-CM018179, MFCD07391531, STK280255, AKOS000284746, MCULE-2537651236, AJ-52533, BC4125357, Y-2900, AN-465/41988532, 4-[(3-methylthiophen-2-yl)methylamino]benzoic acid, 4-[(3-Methyl-thiophen-2-ylmethyl)-amino]-benzoic acid, CID6487249, 4-{[(3-Methyl-2-thienyl)methyl]amino},

Complexity	264
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	247.067g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	247.312g/mol
Monoisotopic Mass	247.067g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	77.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	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