200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 84434-22-0
84434-22-0 | Benzene,3-(1,1-dimethylethyl)-1,5-dimethyl-2,4-dinitro-
CAS No: 84434-22-0 Catalog No: AG004WQA MDL No:
Product Description
Catalog Number:
AG004WQA
Chemical Name:
Benzene,3-(1,1-dimethylethyl)-1,5-dimethyl-2,4-dinitro-
CAS Number:
84434-22-0
Molecular Formula:
C12H16N2O4
Molecular Weight:
252.2664
IUPAC Name:
3-tert-butyl-1,5-dimethyl-2,4-dinitrobenzene
InChI:
InChI=1S/C12H16N2O4/c1-7-6-8(2)11(14(17)18)9(12(3,4)5)10(7)13(15)16/h6H,1-5H3
InChI Key:
ZHFGLQLHVTZCGJ-UHFFFAOYSA-N
SMILES:
CC(c1c([N+](=O)[O-])c(C)cc(c1[N+](=O)[O-])C)(C)C
EC Number:
282-822-1
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.111g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.27g/mol
Monoisotopic Mass:
252.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.