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Home > Nitro Compounds > 129665-15-2
129665-15-2 | 1H-Phenalen-1-one, 9-(2-nitrophenyl)-
CAS No: 129665-15-2 Catalog No: AG000Z9M MDL No:
Product Description
Catalog Number:
AG000Z9M
Chemical Name:
1H-Phenalen-1-one, 9-(2-nitrophenyl)-
CAS Number:
129665-15-2
Molecular Formula:
C19H11NO3
Molecular Weight:
301.2955
IUPAC Name:
9-(2-nitrophenyl)phenalen-1-one
InChI:
InChI=1S/C19H11NO3/c21-17-11-9-13-5-3-4-12-8-10-15(19(17)18(12)13)14-6-1-2-7-16(14)20(22)23/h1-11H
InChI Key:
GHLUHVHLZNQYKR-UHFFFAOYSA-N
SMILES:
O=C1C=Cc2c3c1c(ccc3ccc2)c1ccccc1[N+](=O)[O-]
Properties
Complexity:
523
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.074g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.301g/mol
Monoisotopic Mass:
301.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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