AG00IDZK

862695-75-8 | 3-Pyridinecarboxylic acid, 6-chloro-2-cyclopropyl-

AG00IDZK

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CAS Number	862695-75-8
Catalog Number	AG00IDZK(AGN-PC-0D5BK4)
Chemical Name	3-Pyridinecarboxylic acid, 6-chloro-2-cyclopropyl-
IUPAC Name	6-chloro-2-cyclopropylpyridine-3-carboxylic acid
InChI	InChI=1S/C9H8ClNO2/c10-7-4-3-6(9(12)13)8(11-7)5-1-2-5/h3-5H,1-2H2,(H,12,13)
InChI Key	FZPUPGGRIJXKTC-UHFFFAOYSA-N
MDL Number	MFCD18255903
Molecular Formula	C9H8ClNO2
Molecular Weight	197.6183
SMILES	O=C(O)C1=C(C2CC2)N=C(Cl)C=C1
Synonyms	6-Chloro-2-cyclopropylnicotinic acid, 862695-75-8, AK123510, 3-Pyridinecarboxylic acid, 6-chloro-2-cyclopropyl-, SCHEMBL4649045, DTXSID50733199, FZPUPGGRIJXKTC-UHFFFAOYSA-N, 3488AC, MFCD18255903, ZINC91301449, 6-Chloro-2-cyclopropyl-nicotinic acid, AKOS016011871, DS-7022, FCH1150134, AJ-129669, AX8247688, CS-0060773, FT-0730092, 6-Chloro-2-cyclopropylpyridine-3-carboxylic acid, C9H8ClNO2, 6-Chloro-2-cyclopropylnicotinicacid,

Complexity	218
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.024g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	197.618g/mol
Monoisotopic Mass	197.024g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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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