AG00ANI4

170108-07-3 | Benzoic acid, 2-amino-3,4-difluoro-, methyl ester (9CI)

AG00ANI4

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	170108-07-3
Catalog Number	AG00ANI4(AGN-PC-03RCZ3)
Chemical Name	Benzoic acid, 2-amino-3,4-difluoro-, methyl ester (9CI)
IUPAC Name	methyl 2-amino-3,4-difluorobenzoate
InChI	InChI=1S/C8H7F2NO2/c1-13-8(12)4-2-3-5(9)6(10)7(4)11/h2-3H,11H2,1H3
InChI Key	MQSMXRFDHQTFDU-UHFFFAOYSA-N
MDL Number	MFCD09996886
Molecular Formula	C8H7F2NO2
Molecular Weight	187.1435
SMILES	COC(=O)C1=C(N)C(F)=C(F)C=C1
Synonyms	Methyl 2-Amino-3,4-difluorobenzoate, 170108-07-3, SCHEMBL7558755, CTK6I9796, KS-00000QJN, Benzoic acid, 2-amino-3,4-difluoro-, methyl ester (9CI), DTXSID00627019, ACT00506, 8716AA, ANW-68266, CL8517, MFCD09996886, ZINC31829484, AKOS010308276, AJ-84396, AK-80528, TS-02624, TR-071360, ST24047660, C-6410, C8H7F2NO2, 2-AMINO-3-CHLORO-5-(TRIFLUOROMETHOXY)BENZOIC ACID METHYL ESTER,

Complexity	201
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	187.044g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	187.146g/mol
Monoisotopic Mass	187.044g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number