AG003A8P

394729-98-7 | 2-Chloro-4-methoxynicotinic acid

AG003A8P

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CAS Number	394729-98-7
Catalog Number	AG003A8P(AGN-PC-0O9UK3)
Chemical Name	2-Chloro-4-methoxynicotinic acid
IUPAC Name	2-chloro-4-methoxypyridine-3-carboxylic acid
InChI	InChI=1S/C7H6ClNO3/c1-12-4-2-3-9-6(8)5(4)7(10)11/h2-3H,1H3,(H,10,11)
InChI Key	ZBHVWHBZHRBHRQ-UHFFFAOYSA-N
MDL Number	MFCD18378504
Molecular Formula	C7H6ClNO3
Molecular Weight	187.5804
SMILES	ClC1=C(C(=O)O)C(=CC=N1)OC
Synonyms	2-Chloro-4-methoxynicotinic acid, 394729-98-7, 2-chloro-4-methoxy-3-pyridinecarboxylic acid, AK158984, 3-Pyridinecarboxylic acid, 2-chloro-4-methoxy-, SCHEMBL4969142, KS-00000SHM, MFCD18378504, ZINC98086085, AKOS023832982, FCH1154395, SY038107, TS-02640, AJ-138540, AX8276651, ST2404325, 2-chloro-4-methoxypyridine-3-carboxylic acid, MFCD18378504 (95%),

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	187.004g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	187.579g/mol
Monoisotopic Mass	187.004g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	59.4A^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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