AG005NQG

773108-64-8 | 4-Amino-2,5-difluorobenzoic acid

AG005NQG

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CAS Number	773108-64-8
Catalog Number	AG005NQG(AGN-PC-0UBBRT)
Chemical Name	4-Amino-2,5-difluorobenzoic acid
IUPAC Name	4-amino-2,5-difluorobenzoic acid
InChI	InChI=1S/C7H5F2NO2/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2H,10H2,(H,11,12)
InChI Key	YOXMTBAQSNCVJQ-UHFFFAOYSA-N
MDL Number	MFCD06208208
Molecular Formula	C7H5F2NO2
Molecular Weight	173.1169
SMILES	O=C(O)C1=CC(F)=C(N)C=C1F
Synonyms	4-Amino-2,5-difluorobenzoic acid, 773108-64-8, 4-Amino-2,5-difluorobenzoicacid, 4-amino-2,5-difluoro-benzoic acid, Benzoic acid,4-amino-2,5-difluoro-, 773108-64-8 4-amino-2,5-difluorobenzoic acid, PubChem8202, SCHEMBL99199, KSC644C8J, CTK5E4184, DTXSID70603007, YOXMTBAQSNCVJQ-UHFFFAOYSA-N, 2,5-difluoro-4-aminobenzoic acid, WT055, ANW-46865, CL8910, MFCD06208208, WT2203, ZINC19615461, AKOS006293764, AS04995, Benzoic acid, 4-amino-2,5-difluoro-, LF10764, VZ28190, KS-000011A3, AC-28704, AJ-73985, TS-02365, AB0026669, DB-075283, ST2418071, TC-135610, TL8005306, 4CH-000823, A9784, FT-0654187, W8388, Q-9411, I01-6804, Z1741968424, C7H5F2NO2, (1-(5-CARBOXYPENTYL)-3,3-DIMETHYL-3H-INDOL-1-IUM-2-YL)METHANIDE HYDROBROMIDE,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	173.029g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	173.119g/mol
Monoisotopic Mass	173.029g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

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