AG0003A0

100948-83-2 | Benzene, 1,3-dichloro-5-methoxy-2-nitro-

AG0003A0

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CAS Number	100948-83-2
Catalog Number	AG0003A0(AGN-PC-0L8ZPE)
Chemical Name	Benzene, 1,3-dichloro-5-methoxy-2-nitro-
IUPAC Name	1,3-dichloro-5-methoxy-2-nitrobenzene
InChI	InChI=1S/C7H5Cl2NO3/c1-13-4-2-5(8)7(10(11)12)6(9)3-4/h2-3H,1H3
InChI Key	ZXJNASYUWVEBAH-UHFFFAOYSA-N
MDL Number	MFCD00983851
Molecular Formula	C7H5Cl2NO3
Molecular Weight	222.0255
SMILES	C1C(=C([N+]([O-])=O)C(Cl)=CC=1OC)Cl
Synonyms	1,3-dichloro-5-methoxy-2-nitrobenzene, 100948-83-2, 1,3-Dichloro-5-methoxy-2-nitro-benzene, 3,5-Dichloro-4-nitroanisole;1,3-Dichloro-2-methoxy-5-nitrobenzene, PubChem22693, AC1N82JA, SCHEMBL11126330, DTXSID70401828, ZINC1512456, 9616AH, MFCD00983851, AKOS005174361, AS04441, FCH1601797, LS10046, 1,3-Dichloro-2-nitrobenzene-5-methoxy, AJ-26486, AK126071, AS-33034, AX8176178, Benzene, 1,3-dichloro-5-methoxy-2-nitro-, ST24036794, Z-5342, C7H5Cl2NO3, ZINC01512456, CID4312075, 17742-69-7,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.965g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	222.021g/mol
Monoisotopic Mass	220.965g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	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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