4-ethyl-1-(2-phenylethenyl)-9H-fluorene

C23H20 — CID 150068313

IUPAC4-ethyl-1-(2-phenylethenyl)-9H-fluorene
SMILESCCc1ccc(C=Cc2ccccc2)c2c1-c1ccccc1C2
InChIInChI=1S/C23H20/c1-2-18-14-15-19(13-12-17-8-4-3-5-9-17)22-16-20-10-6-7-11-21(20)23(18)22/h3-15H,2,16H2,1H3
InChIKeyDOTBHQKOVUETSV-UHFFFAOYSA-N
MW296.41 g/mol
LogP5.99
Rot. Bonds3

About 4-ethyl-1-(2-phenylethenyl)-9H-fluorene

4-ethyl-1-(2-phenylethenyl)-9H-fluorene (PubChem CID 150068313) has the molecular formula C23H20 and a molecular weight of 296.41 g/mol. Its IUPAC name is 4-ethyl-1-(2-phenylethenyl)-9H-fluorene.

Molecular Properties

Compound Name4-ethyl-1-(2-phenylethenyl)-9H-fluorene
PubChem CID150068313
Molecular FormulaC23H20
Molecular Weight296.41 g/mol
Exact Mass296.16
IUPAC Name4-ethyl-1-(2-phenylethenyl)-9H-fluorene
SMILESCCc1ccc(C=Cc2ccccc2)c2c1-c1ccccc1C2
InChIInChI=1S/C23H20/c1-2-18-14-15-19(13-12-17-8-4-3-5-9-17)22-16-20-10-6-7-11-21(20)23(18)22/h3-15H,2,16H2,1H3
InChIKeyDOTBHQKOVUETSV-UHFFFAOYSA-N
XLogP5.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.41
LogP ≤ 55.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

4-ethyl-1-[2-(4-ethylphenyl)phenyl]-9H-fluorene
CID 150954424
1-ethyl-2-[(Z)-2-phenylethenyl]benzene
CID 142017215
1-(4-ethyl-9H-fluoren-1-yl)piperazine
CID 150977452
2,3-diethyl-6-(2-phenylethenyl)aniline
CID 70441795
1-(2-ethyl-9H-fluoren-1-yl)-4,5-dimethyl-9H-fluorene
CID 22912623
2-(1-ethyl-9H-fluoren-2-yl)acetic acid
CID 158650084
1,2-diethyl-9H-fluorene
CID 23440471
1-ethenyl-2-ethyl-9H-fluorene
CID 158586423
5-[2-[2-[(E)-2-phenylethenyl]phenyl]phenyl]pentan-2-one
CID 141453211
ethane;1-ethyl-9H-fluorene;propane
CID 167686584
1-ethyl-9H-fluorene;prop-2-enoic acid
CID 175512160
1-butyl-2-[2-[(E)-2-phenylethenyl]phenyl]benzene
CID 141453206

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1-(2-phenylethenyl)-9H-fluorene?
The IUPAC name of 4-ethyl-1-(2-phenylethenyl)-9H-fluorene (CID 150068313) is 4-ethyl-1-(2-phenylethenyl)-9H-fluorene.
What is the SMILES notation for 4-ethyl-1-(2-phenylethenyl)-9H-fluorene?
The canonical SMILES for 4-ethyl-1-(2-phenylethenyl)-9H-fluorene is CCc1ccc(C=Cc2ccccc2)c2c1-c1ccccc1C2.
What is the InChIKey of 4-ethyl-1-(2-phenylethenyl)-9H-fluorene?
The InChIKey is DOTBHQKOVUETSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20/c1-2-18-14-15-19(13-12-17-8-4-3-5-9-17)22-16-20-10-6-7-11-21(20)23(18)22/h3-15H,2,16H2,1H3.
What are the key properties of 4-ethyl-1-(2-phenylethenyl)-9H-fluorene?
4-ethyl-1-(2-phenylethenyl)-9H-fluorene has a molecular weight of 296.41 g/mol, XLogP of 5.99, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1-(2-phenylethenyl)-9H-fluorene is sourced from PubChem (CID 150068313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).