AG007VWW

1060805-95-9 | 4-Chloro-6-Methylnicotinic acid

AG007VWW

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CAS Number	1060805-95-9
Catalog Number	AG007VWW(AGN-PC-07HAX8)
Chemical Name	4-Chloro-6-Methylnicotinic acid
IUPAC Name	4-chloro-6-methylpyridine-3-carboxylic acid
InChI	InChI=1S/C7H6ClNO2/c1-4-2-6(8)5(3-9-4)7(10)11/h2-3H,1H3,(H,10,11)
InChI Key	NPFSHIQNHIGKKL-UHFFFAOYSA-N
MDL Number	MFCD11520850
Molecular Formula	C7H6ClNO2
Molecular Weight	171.5810
SMILES	O=C(O)C1=CN=C(C)C=C1Cl
Synonyms	4-Chloro-6-methylnicotinic acid, 1060805-95-9, 4-chloro-6-methylpyridine-3-carboxylic acid, 4-Chloro-6-methylnicotinicAcid, SCHEMBL1105936, CTK8B7102, KS-00000PPI, DTXSID70671983, ANW-56370, MFCD11520850, ZINC40448460, AKOS006323471, CS-W005731, MCULE-7032581921, NE51813, PB14950, QC-9144, SB10543, 4-CHLORO-6-METHYL-NICOTINIC ACID, AK-28459, DS-11033, SC-03747, SY024330, AB0053600, AJ-102745, ST2411337, TC-145115, 4CH-011417, V2042, MFCD11520850 (97%), C7H6ClNO2, 56022-09-4,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.009g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	171.58g/mol
Monoisotopic Mass	171.009g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number