200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 155694-84-1
155694-84-1 | Ethanone, 1-(4-methyl-2-nitrophenyl)-
CAS No: 155694-84-1 Catalog No: AG001O3W MDL No:
Product Description
Catalog Number:
AG001O3W
Chemical Name:
Ethanone, 1-(4-methyl-2-nitrophenyl)-
CAS Number:
155694-84-1
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
IUPAC Name:
1-(4-methyl-2-nitrophenyl)ethanone
InChI:
InChI=1S/C9H9NO3/c1-6-3-4-8(7(2)11)9(5-6)10(12)13/h3-5H,1-2H3
InChI Key:
UPVDTZDVDGTUEP-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)[N+](=O)[O-])C(=O)C
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.175g/mol
Monoisotopic Mass:
179.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.