200,000+ products from a single source!
sales@angenechem.com
823180-31-0 | Hexane, 1,1-diiodo-5-methyl-5-nitro-
CAS No: 823180-31-0 Catalog No: AG00552R MDL No:
Product Description
Catalog Number:
AG00552R
Chemical Name:
Hexane, 1,1-diiodo-5-methyl-5-nitro-
CAS Number:
823180-31-0
Molecular Formula:
C7H13I2NO2
Molecular Weight:
396.9926
IUPAC Name:
1,1-diiodo-5-methyl-5-nitrohexane
InChI:
InChI=1S/C7H13I2NO2/c1-7(2,10(11)12)5-3-4-6(8)9/h6H,3-5H2,1-2H3
InChI Key:
UMWCEXVIOROLLR-UHFFFAOYSA-N
SMILES:
IC(CCCC([N+](=O)[O-])(C)C)I
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.904g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.995g/mol
Monoisotopic Mass:
396.904g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.