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190-95-4 | Dibenzo[b,pqr]perylene
CAS No: 190-95-4 Catalog No: AG002E7R MDL No:
Product Description
Catalog Number:
AG002E7R
Chemical Name:
Dibenzo[b,pqr]perylene
CAS Number:
190-95-4
Molecular Formula:
C26H14
Molecular Weight:
326.3894
IUPAC Name:
heptacyclo[12.12.0.02,11.03,8.04,25.015,20.021,26]hexacosa-1(14),2(11),3(8),4,6,9,12,15,17,19,21(26),22,24-tridecaene
InChI:
InChI=1S/C26H14/c1-2-7-18-17(6-1)19-9-4-10-21-20-8-3-5-15-11-12-16-13-14-22(18)26(25(19)21)24(16)23(15)20/h1-14H
InChI Key:
UJPJAAQMHAHWRM-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)c1cccc3c1c1c2ccc2c1c1c3cccc1cc2
Properties
Complexity:
564
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.11g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.398g/mol
Monoisotopic Mass:
326.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1
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