AG00GSN9

915369-46-9 | 4,8-Dichloro-6-nitroquinoline-3-carbonitrile

AG00GSN9

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CAS Number	915369-46-9
Catalog Number	AG00GSN9(AGN-PC-01LXD8)
Chemical Name	4,8-Dichloro-6-nitroquinoline-3-carbonitrile
IUPAC Name	4,8-dichloro-6-nitroquinoline-3-carbonitrile
InChI	InChI=1S/C10H3Cl2N3O2/c11-8-2-6(15(16)17)1-7-9(12)5(3-13)4-14-10(7)8/h1-2,4H
InChI Key	MPJQECCTXQJBOS-UHFFFAOYSA-N
MDL Number	MFCD09261389
Molecular Formula	C10H3Cl2N3O2
Molecular Weight	268.0557
SMILES	N#CC1=C(Cl)C2=CC([N+]([O-])=O)=CC(Cl)=C2N=C1
Synonyms	4,8-Dichloro-6-nitroquinoline-3-carbonitrile, 915369-46-9, 4,8-Dichloro-6-nitro-quinoline-3-carbonitrile, 4,8-dichloro-6-nitro-3-quinolinecarbonitrile, 3-Quinolinecarbonitrile, 4,8-dichloro-6-nitro-, C10H3Cl2N3O2, SCHEMBL4960627, CTK5G9757, DTXSID50590860, MPJQECCTXQJBOS-UHFFFAOYSA-N, CS-B0213, 5392AC, ANW-53902, MFCD09261389, ZINC16697815, AKOS016000233, RP29539, AJ-69410, CS-13987, AX8092983, DB-079062, RT-019945, FT-0751750, 3-Quinolinecarbonitrile,4,8-dichloro-6-nitro-, X-2044, A843968, 4-chloro-8-chloro-6-nitro-quinoline-3-carbonitrile, J-514182, 4,8-bis(chloranyl)-6-nitro-quinoline-3-carbonitrile,

Complexity	364
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	266.96g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	268.053g/mol
Monoisotopic Mass	266.96g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	82.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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