AG000FTH

1150617-61-0 | Benzene, 5-chloro-2-iodo-1-methyl-3-nitro-

AG000FTH

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CAS Number	1150617-61-0
Catalog Number	AG000FTH(AGN-PC-0WAMV8)
Chemical Name	Benzene, 5-chloro-2-iodo-1-methyl-3-nitro-
IUPAC Name	5-chloro-2-iodo-1-methyl-3-nitrobenzene
InChI	InChI=1S/C7H5ClINO2/c1-4-2-5(8)3-6(7(4)9)10(11)12/h2-3H,1H3
InChI Key	WFRAPEVRKRASCC-UHFFFAOYSA-N
MDL Number	MFCD12024407
Molecular Formula	C7H5ClINO2
Molecular Weight	297.4776
SMILES	c1c(cc(c(c1[N+](=O)[O-])I)C)Cl
Synonyms	5-chloro-2-iodo-1-methyl-3-nitrobenzene, 1150617-61-0, 5-Chloro-2-iodo-3-nitrotoluene, KS-00000PXV, DTXSID70653921, 2474AA, MFCD12024407, ZINC32914707, AKOS015917612, DS-4490, AJ-85626, AK109878, SC-90398, DB-057934, ST2401909, 4CH-019700, FT-0659505, Benzene, 5-chloro-2-iodo-1-methyl-3-nitro-, 5-chloranyl-2-iodanyl-1-methyl-3-nitro-benzene, A803297, S01-0052, C7H5ClINO2,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	296.905g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	297.476g/mol
Monoisotopic Mass	296.905g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number