AG0004UP

101580-70-5 | Benzene, 1,2-dibromo-4-methyl-5-nitro-

AG0004UP

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CAS Number	101580-70-5
Catalog Number	AG0004UP(AGN-PC-0BT0Z2)
Chemical Name	Benzene, 1,2-dibromo-4-methyl-5-nitro-
EC Number	600-228-6
IUPAC Name	1,2-dibromo-4-methyl-5-nitrobenzene
InChI	InChI=1S/C7H5Br2NO2/c1-4-2-5(8)6(9)3-7(4)10(11)12/h2-3H,1H3
InChI Key	OJFOMLFOBYEZNH-UHFFFAOYSA-N
MDL Number	MFCD23135744
Molecular Formula	C7H5Br2NO2
Molecular Weight	294.9281
SMILES	CC1=CC(Br)=C(Br)C=C1[N+]([O-])=O
Synonyms	1,2-Dibromo-4-methyl-5-nitrobenzene, 101580-70-5, Benzene, 1,2-dibromo-4-methyl-5-nitro-, ACMC-20aes8, 4,5-Dibromo-2-nitrotoluene, SCHEMBL2442735, CTK0G8098, KS-00000QUP, DTXSID20726275, OJFOMLFOBYEZNH-UHFFFAOYSA-N, ANW-70086, MFCD23135744, ZINC82046747, AKOS016001619, DS-3565, AK100606, AJ-124442, TC-158831, 4CH-012213, ST24020923, Y5847, C7H5Br2NO2,

Complexity	183
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	294.867g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	294.93g/mol
Monoisotopic Mass	292.869g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

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