12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene

C28H28 — CID 147795463

IUPAC12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene
SMILESc1ccc(C2(c3ccccc3)C3=C(CCCCCCC3)c3ccccc32)cc1
InChIInChI=1S/C28H28/c1-2-10-18-24-25-19-12-13-21-27(25)28(26(24)20-11-3-1,22-14-6-4-7-15-22)23-16-8-5-9-17-23/h4-9,12-17,19,21H,1-3,10-11,18,20H2
InChIKeyHKLXGGJICZUSEN-UHFFFAOYSA-N
MW364.53 g/mol
LogP7.53
Rot. Bonds2

About 12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene

12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene (PubChem CID 147795463) has the molecular formula C28H28 and a molecular weight of 364.53 g/mol. Its IUPAC name is 12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene.

Molecular Properties

Compound Name12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene
PubChem CID147795463
Molecular FormulaC28H28
Molecular Weight364.53 g/mol
Exact Mass364.22
IUPAC Name12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene
SMILESc1ccc(C2(c3ccccc3)C3=C(CCCCCCC3)c3ccccc32)cc1
InChIInChI=1S/C28H28/c1-2-10-18-24-25-19-12-13-21-27(25)28(26(24)20-11-3-1,22-14-6-4-7-15-22)23-16-8-5-9-17-23/h4-9,12-17,19,21H,1-3,10-11,18,20H2
InChIKeyHKLXGGJICZUSEN-UHFFFAOYSA-N
XLogP7.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.53
LogP ≤ 57.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene with MolForge

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Related Compounds

9,9-diphenylfluorene;methane
CID 145331804
9,9-diphenylfluorene;methane
CID 145140147
9,9-diphenylfluorene;9,9'-spirobi[fluorene];spiro[cyclopentane-1,9'-fluorene]
CID 159194629
9,9-diphenylfluorene;propane
CID 158205050
9,9,18,18,27,27-hexakis-phenylheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene
CID 59217347
9,9-diphenylfluorene;methoxymethane
CID 143139467
N-(cyclohexen-1-yl)-9,9-diphenylfluoren-2-amine
CID 138581690
bis(9,9-diphenylfluorene);ethane;propane
CID 144938803
9-(4-ethylphenyl)-9-phenylfluorene
CID 149284542
1-phenylpentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8,10,12(20),14,16,18-nonaene
CID 144907616
4-(9-phenylfluoren-9-yl)pyridine
CID 130393979
9-(2-fluorophenyl)-9-phenylfluorene
CID 102442885

Frequently Asked Questions

What is the IUPAC name of 12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene?
The IUPAC name of 12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene (CID 147795463) is 12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene.
What is the SMILES notation for 12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene?
The canonical SMILES for 12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene is c1ccc(C2(c3ccccc3)C3=C(CCCCCCC3)c3ccccc32)cc1.
What is the InChIKey of 12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene?
The InChIKey is HKLXGGJICZUSEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28/c1-2-10-18-24-25-19-12-13-21-27(25)28(26(24)20-11-3-1,22-14-6-4-7-15-22)23-16-8-5-9-17-23/h4-9,12-17,19,21H,1-3,10-11,18,20H2.
What are the key properties of 12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene?
12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene has a molecular weight of 364.53 g/mol, XLogP of 7.53, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 12,12-diphenyl-6,7,8,9,10,11-hexahydro-5H-cyclonona[a]indene is sourced from PubChem (CID 147795463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).