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Home > Nitro Compounds > 183061-37-2
183061-37-2 | 1H-Inden-1-one, 2,3-dihydro-7-nitro-
CAS No: 183061-37-2 Catalog No: AG0024DD MDL No:
Product Description
Catalog Number:
AG0024DD
Chemical Name:
1H-Inden-1-one, 2,3-dihydro-7-nitro-
CAS Number:
183061-37-2
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
IUPAC Name:
7-nitro-2,3-dihydroinden-1-one
InChI:
InChI=1S/C9H7NO3/c11-8-5-4-6-2-1-3-7(9(6)8)10(12)13/h1-3H,4-5H2
InChI Key:
FFNWINZISCEKBH-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc2c1C(=O)CC2
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:
1.5
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