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114221-73-7 | Triphenylene, 1,4,5,8,9,12-hexahydro-
CAS No: 114221-73-7 Catalog No: AG000AVJ MDL No:
Product Description
Catalog Number:
AG000AVJ
Chemical Name:
Triphenylene, 1,4,5,8,9,12-hexahydro-
CAS Number:
114221-73-7
Molecular Formula:
C18H18
Molecular Weight:
234.3355
IUPAC Name:
1,4,5,8,9,12-hexahydrotriphenylene
InChI:
InChI=1S/C18H18/c1-2-8-14-13(7-1)15-9-3-4-11-17(15)18-12-6-5-10-16(14)18/h1-6H,7-12H2
InChI Key:
VTYPJUFNVBQIKR-UHFFFAOYSA-N
SMILES:
C1=CCc2c(C1)c1CC=CCc1c1c2CC=CC1
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.141g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.342g/mol
Monoisotopic Mass:
234.141g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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