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80692-95-1 | 5h-cyclopenta[b]phenanthren-5-one
CAS No: 80692-95-1 Catalog No: AG005JXH MDL No:
Product Description
Catalog Number:
AG005JXH
Chemical Name:
5h-cyclopenta[b]phenanthren-5-one
CAS Number:
80692-95-1
Molecular Formula:
C17H10O
Molecular Weight:
230.2607
IUPAC Name:
cyclopenta[b]phenanthren-5-one
InChI:
InChI=1S/C17H10O/c18-17-10-13-8-11-4-3-5-12(11)9-16(13)14-6-1-2-7-15(14)17/h1-10H
InChI Key:
HDBVHBILKHCQQR-UHFFFAOYSA-N
SMILES:
O=C1C=c2cc3C=CC=c3cc2c2c1cccc2
Properties
Complexity:
581
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.073g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.266g/mol
Monoisotopic Mass:
230.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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