200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 926640-81-5
926640-81-5 | Cyclohexanone, 2-(3-methyl-2-nitrophenyl)-
CAS No: 926640-81-5 Catalog No: AG006F12 MDL No:
Product Description
Catalog Number:
AG006F12
Chemical Name:
Cyclohexanone, 2-(3-methyl-2-nitrophenyl)-
CAS Number:
926640-81-5
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
IUPAC Name:
2-(3-methyl-2-nitrophenyl)cyclohexan-1-one
InChI:
InChI=1S/C13H15NO3/c1-9-5-4-7-11(13(9)14(16)17)10-6-2-3-8-12(10)15/h4-5,7,10H,2-3,6,8H2,1H3
InChI Key:
QNQZBEHPNQQNPY-UHFFFAOYSA-N
SMILES:
O=C1CCCCC1c1cccc(c1[N+](=O)[O-])C
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.105g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.267g/mol
Monoisotopic Mass:
233.105g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.