9-buta-1,2,3-trienylidenefluorene

C17H10 — CID 101044395

IUPAC9-buta-1,2,3-trienylidenefluorene
SMILESC=C=C=C=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C17H10/c1-2-3-8-13-14-9-4-6-11-16(14)17-12-7-5-10-15(13)17/h4-7,9-12H,1H2
InChIKeyCNALXZWAAANBDV-UHFFFAOYSA-N
MW214.27 g/mol
LogP4.19
Rot. Bonds

About 9-buta-1,2,3-trienylidenefluorene

9-buta-1,2,3-trienylidenefluorene (PubChem CID 101044395) has the molecular formula C17H10 and a molecular weight of 214.27 g/mol. Its IUPAC name is 9-buta-1,2,3-trienylidenefluorene.

Molecular Properties

Compound Name9-buta-1,2,3-trienylidenefluorene
PubChem CID101044395
Molecular FormulaC17H10
Molecular Weight214.27 g/mol
Exact Mass214.08
IUPAC Name9-buta-1,2,3-trienylidenefluorene
SMILESC=C=C=C=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C17H10/c1-2-3-8-13-14-9-4-6-11-16(14)17-12-7-5-10-15(13)17/h4-7,9-12H,1H2
InChIKeyCNALXZWAAANBDV-UHFFFAOYSA-N
XLogP4.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 9-buta-1,2,3-trienylidenefluorene?
The IUPAC name of 9-buta-1,2,3-trienylidenefluorene (CID 101044395) is 9-buta-1,2,3-trienylidenefluorene.
What is the SMILES notation for 9-buta-1,2,3-trienylidenefluorene?
The canonical SMILES for 9-buta-1,2,3-trienylidenefluorene is C=C=C=C=C1c2ccccc2-c2ccccc21.
What is the InChIKey of 9-buta-1,2,3-trienylidenefluorene?
The InChIKey is CNALXZWAAANBDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10/c1-2-3-8-13-14-9-4-6-11-16(14)17-12-7-5-10-15(13)17/h4-7,9-12H,1H2.
What are the key properties of 9-buta-1,2,3-trienylidenefluorene?
9-buta-1,2,3-trienylidenefluorene has a molecular weight of 214.27 g/mol, XLogP of 4.19, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-buta-1,2,3-trienylidenefluorene is sourced from PubChem (CID 101044395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).