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Home > Nitro Compounds > 7206-56-6
7206-56-6 | Azulene, 1-nitro-
CAS No: 7206-56-6 Catalog No: AG005DB0 MDL No:
Product Description
Catalog Number:
AG005DB0
Chemical Name:
Azulene, 1-nitro-
CAS Number:
7206-56-6
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
IUPAC Name:
1-nitroazulene
InChI:
InChI=1S/C10H7NO2/c12-11(13)10-7-6-8-4-2-1-3-5-9(8)10/h1-7H
InChI Key:
ANMVHJPIGPTCSG-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c1ccccc2
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.048g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.171g/mol
Monoisotopic Mass:
173.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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