200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 13402-31-8
13402-31-8 | 1,3,5-triisopropyl-2-nitrobenzene
CAS No: 13402-31-8 Catalog No: AG01CAVV MDL No:MFCD00101286
Product Description
Catalog Number:
AG01CAVV
Chemical Name:
1,3,5-triisopropyl-2-nitrobenzene
CAS Number:
13402-31-8
Molecular Formula:
C15H23NO2
Molecular Weight:
249.3486
MDL Number:
MFCD00101286
IUPAC Name:
2-nitro-1,3,5-tri(propan-2-yl)benzene
InChI:
InChI=1S/C15H23NO2/c1-9(2)12-7-13(10(3)4)15(16(17)18)14(8-12)11(5)6/h7-11H,1-6H3
InChI Key:
FGBSHFPGPYKJJD-UHFFFAOYSA-N
SMILES:
CC(c1cc(cc(c1[N+](=O)[O-])C(C)C)C(C)C)C
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.173g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.354g/mol
Monoisotopic Mass:
249.173g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.