96155-98-5
BENZENE, 1,2-DIMETHYL-3-(1-METHYLETHYL)-5-NITRO
NameBENZENE, 1,2-DIMETHYL-3-(1-METHYLETHYL)-5-NITRO
1Identification
【Name】
BENZENE, 1,2-DIMETHYL-3-(1-METHYLETHYL)-5-NITRO
【CAS】
【MDL】
MFCD09751160
【EnglishSynonyms】
【pro_formula】
C11 H15 N O2
【pro_molWeight】
193.245
【Inchi】
InChI=1S/C11H15NO2/c1-7(2)11-6-10(12(13)14)5-8(3)9(11)4/h5-7H,1-4H3
【InChIKey】
InChIKey=LWXYRCYAGNMAMJ-UHFFFAOYSA-N
【SMILES】
Cc1cc(cc(c1C)C(C)C)[N+](=O)[O-]
【MOL File】
BENZENE, 1,2-DIMETHY….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:3
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
BENZENE, 1,2-DIMETHYL-3-(1-METHYLETHYL)-5-NITRO.cml