AG00IFST

89692-81-9 | 1,3-Dichloro-5-methyl-2-nitrobenzene

AG00IFST

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CAS Number	89692-81-9
Catalog Number	AG00IFST(AGN-PC-0WCYWS)
Chemical Name	1,3-Dichloro-5-methyl-2-nitrobenzene
IUPAC Name	1,3-dichloro-5-methyl-2-nitrobenzene
InChI	InChI=1S/C7H5Cl2NO2/c1-4-2-5(8)7(10(11)12)6(9)3-4/h2-3H,1H3
InChI Key	POAILBXQTJDSFV-UHFFFAOYSA-N
MDL Number	MFCD22648298
Molecular Formula	C7H5Cl2NO2
Molecular Weight	206.0261
SMILES	CC1=CC(Cl)=C([N+]([O-])=O)C(Cl)=C1
Synonyms	1,3-dichloro-5-methyl-2-nitrobenzene, 3,5-DICHLORO-4-NITROTOLUENE, 89692-81-9, SCHEMBL9495799, CL9110, MFCD22648298, ZINC34406374, FCH2306650, AK342499, AS-46210, CS-0061217,

Complexity	171
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	204.97g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	206.022g/mol
Monoisotopic Mass	204.97g/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
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number