AG0039P9

154314-62-2 | 4-Amino-2,6-difluorobenzoic acid

AG0039P9

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CAS Number	154314-62-2
Catalog Number	AG0039P9(AGN-PC-0NDSSH)
Chemical Name	4-Amino-2,6-difluorobenzoic acid
IUPAC Name	4-amino-2,6-difluorobenzoic acid
InChI	InChI=1S/C7H5F2NO2/c8-4-1-3(10)2-5(9)6(4)7(11)12/h1-2H,10H2,(H,11,12)
InChI Key	RZYUIHNYUYKPOQ-UHFFFAOYSA-N
MDL Number	MFCD03407441
Molecular Formula	C7H5F2NO2
Molecular Weight	173.1169
SMILES	NC1=CC(=C(C(=O)O)C(=C1)F)F
Synonyms	4-amino-2,6-difluorobenzoic acid, 154314-62-2, 4-Amino-2,6-difluoro- benzoic acid, 4-amino-2,6-difluoro-benzoic Acid, SCHEMBL614717, KS-00000TJW, RZYUIHNYUYKPOQ-UHFFFAOYSA-N, MFCD03407441, ZINC71790350, AKOS006278594, Benzoic acid, 4-amino-2,6-difluoro-, MCULE-6607539565, NE48600, AK271408, AS-47593, EN300-92070, Z1269638524, CID10975964,

Complexity	176
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

Lot Number