AG00FBYT

73387-74-3 | 3-Quinolinecarbonitrile, 4-chloro-7-methoxy-

AG00FBYT

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CAS Number	73387-74-3
Catalog Number	AG00FBYT(AGN-PC-0WAJBN)
Chemical Name	3-Quinolinecarbonitrile, 4-chloro-7-methoxy-
IUPAC Name	4-chloro-7-methoxyquinoline-3-carbonitrile
InChI	InChI=1S/C11H7ClN2O/c1-15-8-2-3-9-10(4-8)14-6-7(5-13)11(9)12/h2-4,6H,1H3
InChI Key	WMBCMCMNNWELKB-UHFFFAOYSA-N
MDL Number	MFCD12068428
Molecular Formula	C11H7ClN2O
Molecular Weight	218.6391
SMILES	N#CC1=C(Cl)C2=CC=C(OC)C=C2N=C1
Synonyms	73387-74-3, 4-chloro-7-methoxyquinoline-3-carbonitrile, 3-Cyano-4-chloro-7-methoxyquinoline, 3-Quinolinecarbonitrile, 4-chloro-7-methoxy-, 3-Quinolinecarbonitrile,4-chloro-7-methoxy-, 4-chloro-7-methoxy-quinoline-3-carbonitrile, SCHEMBL6382801, KS-00001DMB, DTXSID90502543, WMBCMCMNNWELKB-UHFFFAOYSA-N, CS-B0217, 3235AH, BBL005581, MFCD12068428, STL134807, ZINC39246714, AKOS005745192, MCULE-6696049468, 4chloro-7-methoxy-3-quinolinecarbonitrile, AJ-99351, AS-37300, 4-chloro-7-methoxy-3-quinolinecarbonitrile, AB0075735, AX8266774, 4-chloro-7-methoxy -3-quinolinecarbonitrile, X-2514, C11H7ClN2O,

Complexity	275
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	218.025g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	218.64g/mol
Monoisotopic Mass	218.025g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	45.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

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

Lot Number