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1173-38-2 | Tribenzo[a,fg,op]naphthacene
CAS No: 1173-38-2 Catalog No: AG000E35 MDL No:
Product Description
Catalog Number:
AG000E35
Chemical Name:
Tribenzo[a,fg,op]naphthacene
CAS Number:
1173-38-2
Molecular Formula:
C28H16
Molecular Weight:
352.4266
IUPAC Name:
heptacyclo[14.10.2.02,11.03,8.012,28.017,22.023,27]octacosa-1(26),2(11),3,5,7,9,12,14,16(28),17,19,21,23(27),24-tetradecaene
InChI:
InChI=1S/C28H16/c1-2-8-18-17(7-1)15-16-24-23-13-5-11-21-19-9-3-4-10-20(19)22-12-6-14-25(26(18)24)28(22)27(21)23/h1-16H
InChI Key:
YUHPGHXIRUQSHT-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)ccc1c2c2cccc3c2c2c1cccc2c1c3cccc1
Properties
Complexity:
593
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:
8.9
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