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114959-37-4 | Cyclopent[hi]acephenanthrylene
CAS No: 114959-37-4 Catalog No: AG000FI8 MDL No:
Product Description
Catalog Number:
AG000FI8
Chemical Name:
Cyclopent[hi]acephenanthrylene
CAS Number:
114959-37-4
Molecular Formula:
C18H10
Molecular Weight:
226.2720
IUPAC Name:
pentacyclo[8.6.1.12,5.014,17.09,18]octadeca-1,3,5(18),6,8,10,12,14(17),15-nonaene
InChI:
InChI=1S/C18H10/c1-3-11-7-9-15-16-10-8-12-4-2-6-14(18(12)16)13(5-1)17(11)15/h1-10H
InChI Key:
OGSMXDUSWZTIEB-UHFFFAOYSA-N
SMILES:
c1cc2ccc3c2c(c1)c1cccc2c1c3cc2
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.078g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.278g/mol
Monoisotopic Mass:
226.078g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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