1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene

C27H24 — CID 18477278

IUPAC1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene
SMILESCC(C)(C1=CC(c2ccccc2)=CC1)c1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C27H24/c1-27(2,22-16-15-20(17-22)19-9-4-3-5-10-19)26-14-8-13-24-23-12-7-6-11-21(23)18-25(24)26/h3-15,17H,16,18H2,1-2H3
InChIKeyVBUVMZRZUHPOGZ-UHFFFAOYSA-N
MW348.49 g/mol
LogP6.95
Rot. Bonds3

About 1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene

1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene (PubChem CID 18477278) has the molecular formula C27H24 and a molecular weight of 348.49 g/mol. Its IUPAC name is 1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene.

Molecular Properties

Compound Name1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene
PubChem CID18477278
Molecular FormulaC27H24
Molecular Weight348.49 g/mol
Exact Mass348.19
IUPAC Name1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene
SMILESCC(C)(C1=CC(c2ccccc2)=CC1)c1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C27H24/c1-27(2,22-16-15-20(17-22)19-9-4-3-5-10-19)26-14-8-13-24-23-12-7-6-11-21(23)18-25(24)26/h3-15,17H,16,18H2,1-2H3
InChIKeyVBUVMZRZUHPOGZ-UHFFFAOYSA-N
XLogP6.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.49
LogP ≤ 56.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-[2-(9H-fluoren-1-yl)but-3-yn-2-yl]-9H-fluorene
CID 151464335
1-[9H-fluoren-1-yl(diphenyl)methyl]-9H-fluorene
CID 141254702
1-tert-butyl-2-phenyl-9H-fluorene
CID 172750922
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
1-[2-(4-phenylphenyl)phenyl]-9H-fluorene
CID 174460318
1,3-ditert-butyl-9H-fluorene
CID 175163483
N-[1,2-dichloro-1-(9H-fluoren-1-yl)ethyl]-2-methylpropan-2-amine
CID 87185294
1,1-bis(9H-fluoren-1-yl)ethyl carbamate
CID 151505188
1-[(E)-2-cyclopenta-1,3-dien-1-ylhex-3-en-2-yl]-9H-fluorene
CID 22373058
bis(9H-fluoren-1-yl)-dimethylgermane
CID 22068853
1-[2-(4-tert-butyl-2-methylcyclopenta-2,4-dien-1-yl)propan-2-yl]-9H-fluorene
CID 131725120
1-(9H-fluoren-1-yl)-2,3,4-triphenyl-9H-fluorene
CID 150664526

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene?
The IUPAC name of 1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene (CID 18477278) is 1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene.
What is the SMILES notation for 1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene?
The canonical SMILES for 1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene is CC(C)(C1=CC(c2ccccc2)=CC1)c1cccc2c1Cc1ccccc1-2.
What is the InChIKey of 1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene?
The InChIKey is VBUVMZRZUHPOGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24/c1-27(2,22-16-15-20(17-22)19-9-4-3-5-10-19)26-14-8-13-24-23-12-7-6-11-21(23)18-25(24)26/h3-15,17H,16,18H2,1-2H3.
What are the key properties of 1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene?
1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene has a molecular weight of 348.49 g/mol, XLogP of 6.95, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-phenylcyclopenta-1,3-dien-1-yl)propan-2-yl]-9H-fluorene is sourced from PubChem (CID 18477278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).