AG008YET

1060808-94-7 | 6-AMINO-4-CHLORO-NICOTINIC ACID

AG008YET

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CAS Number	1060808-94-7
Catalog Number	AG008YET(AGN-PC-0WAGR0)
Chemical Name	6-AMINO-4-CHLORO-NICOTINIC ACID
IUPAC Name	6-amino-4-chloropyridine-3-carboxylic acid
InChI	InChI=1S/C6H5ClN2O2/c7-4-1-5(8)9-2-3(4)6(10)11/h1-2H,(H2,8,9)(H,10,11)
InChI Key	OXBLGNNZCHCRLC-UHFFFAOYSA-N
MDL Number	MFCD13189221
Molecular Formula	C6H5ClN2O2
Molecular Weight	172.5691
SMILES	O=C(O)C1=CN=C(N)C=C1Cl
Synonyms	6-AMINO-4-CHLORONICOTINIC ACID, 1060808-94-7, 6-AMINO-4-CHLORO-NICOTINIC ACID, AK153190, 6-AMINO-4-CHLOROPYRIDIN-3-CARBOXYLIC ACID, SCHEMBL15059144, OXBLGNNZCHCRLC-UHFFFAOYSA-N, MFCD13189221, ZINC95642401, AB67979, DS-7397, FCH1182056, SC-48685, AJ-133411, AX8224158, 3-Pyridinecarboxylic acid, 6-amino-4-chloro-,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.004g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	172.568g/mol
Monoisotopic Mass	172.004g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	76.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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