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188-13-6 | Tetrabenzo[de,h,kl,rst]pentaphene
CAS No: 188-13-6 Catalog No: AG002GMZ MDL No:
Product Description
Catalog Number:
AG002GMZ
Chemical Name:
Tetrabenzo[de,h,kl,rst]pentaphene
CAS Number:
188-13-6
Molecular Formula:
C34H18
Molecular Weight:
426.5067
IUPAC Name:
nonacyclo[16.12.2.12,6.119,23.011,31.012,17.028,32.010,34.027,33]tetratriaconta-1(30),2,4,6(34),7,9,11(31),12,14,16,18(32),19,21,23(33),24,26,28-heptadecaene
InChI:
InChI=1S/C34H18/c1-2-12-24-23(11-1)31-27-15-5-9-19-7-3-13-21(29(19)27)25-17-18-26-22-14-4-8-20-10-6-16-28(30(20)22)32(24)34(26)33(25)31/h1-18H
InChI Key:
JITUTDSDJPQCGO-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)c1c3c4c2c2cccc5c2c(c4ccc3c2c3c1cccc3ccc2)ccc5
Properties
Complexity:
732
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
426.141g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
426.518g/mol
Monoisotopic Mass:
426.141g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.6
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