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Home > Nitro Compounds > 122520-12-1
122520-12-1 | 2(1H)-Naphthalenone, 3,4-dihydro-7-nitro-
CAS No: 122520-12-1 Catalog No: AG0017DQ MDL No:
Product Description
Catalog Number:
AG0017DQ
Chemical Name:
2(1H)-Naphthalenone, 3,4-dihydro-7-nitro-
CAS Number:
122520-12-1
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
IUPAC Name:
7-nitro-3,4-dihydro-1H-naphthalen-2-one
InChI:
InChI=1S/C10H9NO3/c12-10-4-2-7-1-3-9(11(13)14)5-8(7)6-10/h1,3,5H,2,4,6H2
InChI Key:
BIZFHQDZRNKNAU-UHFFFAOYSA-N
SMILES:
O=C1CCc2c(C1)cc(cc2)[N+](=O)[O-]
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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