AG004N4L

84832-02-0 | Methyl 3-amino-2,6-difluorobenzoate

AG004N4L

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CAS Number	84832-02-0
Catalog Number	AG004N4L(AGN-PC-0UUDQJ)
Chemical Name	Methyl 3-amino-2,6-difluorobenzoate
IUPAC Name	methyl 3-amino-2,6-difluorobenzoate
InChI	InChI=1S/C8H7F2NO2/c1-13-8(12)6-4(9)2-3-5(11)7(6)10/h2-3H,11H2,1H3
InChI Key	IUXHGFLADBGDTR-UHFFFAOYSA-N
MDL Number	MFCD13195461
Molecular Formula	C8H7F2NO2
Molecular Weight	187.1435
SMILES	O=C(OC)C1=C(F)C=CC(N)=C1F
Synonyms	methyl 3-amino-2,6-difluorobenzoate, 84832-02-0, methyl3-amino-2,6-difluorophenylacetate, PubChem19821, SCHEMBL912906, CTK3J6511, DTXSID30670230, IUXHGFLADBGDTR-UHFFFAOYSA-N, ACT09054, BCP12305, KS-000011FV, CL8544, MFCD13195461, ZINC38540328, AKOS012322755, methyl 3-amino-2,6-difluoro-benzoate, AM83215, AN-3679, CM12377, PS-8459, QC-1079, 2,4-Difluoro-3-(methoxycarbonyl)aniline, AC-26958, AJ-96381, EN000121, AB0058181, DB-076135, RT-003060, FT-0738256, 3-Amino-2,6-difluorobenzoic acid methyl ester, A11651, X-1213, Benzoic acid, 3-amino-2,6-difluoro-, methyl ester, methyl 3-amino-2,6-difluorophenylacetate, METHYL3-AMINO-2,6-DIFLUOROBENZOATE, (3-AMINO-2,6-DIFLUORO-PHENYL)-ACETIC 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	1.3

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

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