200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 2625-35-6
2625-35-6 | Butane, 2-methyl-3-nitro-
CAS No: 2625-35-6 Catalog No: AG002SGC MDL No:
Product Description
Catalog Number:
AG002SGC
Chemical Name:
Butane, 2-methyl-3-nitro-
CAS Number:
2625-35-6
Molecular Formula:
C5H11NO2
Molecular Weight:
117.1463
IUPAC Name:
2-methyl-3-nitrobutane
InChI:
InChI=1S/C5H11NO2/c1-4(2)5(3)6(7)8/h4-5H,1-3H3
InChI Key:
UITFXFXYGOKSEL-UHFFFAOYSA-N
SMILES:
CC([N+](=O)[O-])C(C)C
Properties
Complexity:
84.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
117.079g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
117.148g/mol
Monoisotopic Mass:
117.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.