200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 827340-50-1
827340-50-1 | 1,1'-Biphenyl, 4,4'-bis[(cyclohexyloxy)methyl]-3,3'-dinitro-
CAS No: 827340-50-1 Catalog No: AG004ZPV MDL No:
Product Description
Catalog Number:
AG004ZPV
Chemical Name:
1,1'-Biphenyl, 4,4'-bis[(cyclohexyloxy)methyl]-3,3'-dinitro-
CAS Number:
827340-50-1
Molecular Formula:
C26H32N2O6
Molecular Weight:
468.5421
IUPAC Name:
1-(cyclohexyloxymethyl)-4-[4-(cyclohexyloxymethyl)-3-nitrophenyl]-2-nitrobenzene
InChI:
InChI=1S/C26H32N2O6/c29-27(30)25-15-19(11-13-21(25)17-33-23-7-3-1-4-8-23)20-12-14-22(26(16-20)28(31)32)18-34-24-9-5-2-6-10-24/h11-16,23-24H,1-10,17-18H2
InChI Key:
WLBOACBFHWWJOT-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1COC1CCCCC1)c1ccc(c(c1)[N+](=O)[O-])COC1CCCCC1
Properties
Complexity:
597
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
468.226g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
468.55g/mol
Monoisotopic Mass:
468.226g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.