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115165-01-0 | Benzo[b]triphenylen-1-ol
CAS No: 115165-01-0 Catalog No: AG000GCP MDL No:
Product Description
Catalog Number:
AG000GCP
Chemical Name:
Benzo[b]triphenylen-1-ol
CAS Number:
115165-01-0
Molecular Formula:
C22H14O
Molecular Weight:
294.3460
IUPAC Name:
benzo[n]triphenylen-8-ol
InChI:
InChI=1S/C22H14O/c23-21-11-5-10-18-16-8-3-4-9-17(16)19-12-14-6-1-2-7-15(14)13-20(19)22(18)21/h1-13,23H
InChI Key:
DTCDZJFAHXOXHY-UHFFFAOYSA-N
SMILES:
Oc1cccc2c1c1cc3ccccc3cc1c1c2cccc1
UNII:
KGD077689E
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.104g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
294.353g/mol
Monoisotopic Mass:
294.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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