200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 116530-60-0
116530-60-0 | 2H-Inden-2-one, 1,3-dihydro-5-nitro-
CAS No: 116530-60-0 Catalog No: AG000CP5 MDL No:MFCD00598938
Product Description
Catalog Number:
AG000CP5
Chemical Name:
2H-Inden-2-one, 1,3-dihydro-5-nitro-
CAS Number:
116530-60-0
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
MDL Number:
MFCD00598938
IUPAC Name:
5-nitro-1,3-dihydroinden-2-one
InChI:
InChI=1S/C9H7NO3/c11-9-4-6-1-2-8(10(12)13)3-7(6)5-9/h1-3H,4-5H2
InChI Key:
VSEBFWRYDORZJI-UHFFFAOYSA-N
SMILES:
O=C1Cc2c(C1)cc(cc2)[N+](=O)[O-]
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.043g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.159g/mol
Monoisotopic Mass:
177.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.