AG00ICJ4

745075-82-5 | 7H-Cyclopenta[b]pyridin-7-one, 2-chloro-5,6-dihydro-4-methyl-

AG00ICJ4

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CAS Number	745075-82-5
Catalog Number	AG00ICJ4(AGN-PC-040WXP)
Chemical Name	7H-Cyclopenta[b]pyridin-7-one, 2-chloro-5,6-dihydro-4-methyl-
IUPAC Name	2-chloro-4-methyl-5,6-dihydrocyclopenta[b]pyridin-7-one
InChI	InChI=1S/C9H8ClNO/c1-5-4-8(10)11-9-6(5)2-3-7(9)12/h4H,2-3H2,1H3
InChI Key	BYEKRDZZIDTNLO-UHFFFAOYSA-N
MDL Number	MFCD18255919
Molecular Formula	C9H8ClNO
Molecular Weight	181.6189
SMILES	O=C1CCC2=C(C)C=C(Cl)N=C21
Synonyms	2-Chloro-4-methyl-5,6-dihydro-7H-cyclopenta[b]pyridin-7-one, 745075-82-5, AK148234, MFCD18255919, ZINC98178395, AKOS022188160, DS-8887, FCH1168699, AJ-139501, AX8285596, 2-Chloro-4-methyl-6,7-dihydro-5H-1-pyrindine-7-one, 2-chloro-4-methyl-5,6-dihydrocyclopenta[b]pyridin-7-one, 7H-Cyclopenta[b]pyridin-7-one, 2-chloro-5,6-dihydro-4-methyl-,

Complexity	207
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	181.029g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	181.619g/mol
Monoisotopic Mass	181.029g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	30A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

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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