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190-36-3 | Dibenzo[a,o]perylene
CAS No: 190-36-3 Catalog No: AG002E88 MDL No:
Product Description
Catalog Number:
AG002E88
Chemical Name:
Dibenzo[a,o]perylene
CAS Number:
190-36-3
Molecular Formula:
C28H16
Molecular Weight:
352.4266
IUPAC Name:
heptacyclo[13.11.1.12,10.03,8.019,27.021,26.014,28]octacosa-1(27),2(28),3,5,7,9,11,13,15,17,19,21,23,25-tetradecaene
InChI:
InChI=1S/C28H16/c1-3-11-21-17(7-1)15-19-9-5-13-23-24-14-6-10-20-16-18-8-2-4-12-22(18)28(26(20)24)27(21)25(19)23/h1-16H
InChI Key:
PYTPIODZIPXLKF-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)c1c3c(c2)cccc3c2c3c1c1ccccc1cc3ccc2
Properties
Complexity:
541
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.125g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.436g/mol
Monoisotopic Mass:
352.125g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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