1-(2-ethenylbut-3-enoxy)-9H-fluorene

C19H18O — CID 68787919

IUPAC1-(2-ethenylbut-3-enoxy)-9H-fluorene
SMILESC=CC(C=C)COc1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C19H18O/c1-3-14(4-2)13-20-19-11-7-10-17-16-9-6-5-8-15(16)12-18(17)19/h3-11,14H,1-2,12-13H2
InChIKeyUMPWPIPISALCER-UHFFFAOYSA-N
MW262.35 g/mol
LogP4.62
Rot. Bonds5

About 1-(2-ethenylbut-3-enoxy)-9H-fluorene

1-(2-ethenylbut-3-enoxy)-9H-fluorene (PubChem CID 68787919) has the molecular formula C19H18O and a molecular weight of 262.35 g/mol. Its IUPAC name is 1-(2-ethenylbut-3-enoxy)-9H-fluorene.

Molecular Properties

Compound Name1-(2-ethenylbut-3-enoxy)-9H-fluorene
PubChem CID68787919
Molecular FormulaC19H18O
Molecular Weight262.35 g/mol
Exact Mass262.14
IUPAC Name1-(2-ethenylbut-3-enoxy)-9H-fluorene
SMILESC=CC(C=C)COc1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C19H18O/c1-3-14(4-2)13-20-19-11-7-10-17-16-9-6-5-8-15(16)12-18(17)19/h3-11,14H,1-2,12-13H2
InChIKeyUMPWPIPISALCER-UHFFFAOYSA-N
XLogP4.62
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(9H-fluoren-1-yloxy)acetaldehyde
CID 87173259
3-(9H-fluoren-1-yloxy)-2-phenylpropan-1-amine
CID 174662912
1-(2-phenylethoxy)-9H-fluorene
CID 151682362
1-(9H-fluoren-1-yloxymethoxyphosphanyl)prop-2-en-1-one
CID 151239971
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
acetic acid;1-(9H-fluoren-1-yloxy)-9H-fluorene
CID 162313144
2-[2-(9H-fluoren-1-yloxy)ethyl]-2-prop-2-enoylbutanedioic acid
CID 151615577
1-[3-(9H-fluoren-1-yl)-2-(2-methylphenyl)phenoxy]propan-2-ol
CID 175197904
bis(9H-fluoren-1-yl) (2R,3R)-2,3-dihydroxybutanedioate
CID 101363551
4-(9H-fluoren-1-yloxy)-2-phenylsulfanylbutan-1-amine
CID 141344324
9H-fluoren-1-ol;prop-1-ene
CID 159607408
4-[2-(9H-fluoren-1-yl)phenoxy]butan-1-ol
CID 151570912

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethenylbut-3-enoxy)-9H-fluorene?
The IUPAC name of 1-(2-ethenylbut-3-enoxy)-9H-fluorene (CID 68787919) is 1-(2-ethenylbut-3-enoxy)-9H-fluorene.
What is the SMILES notation for 1-(2-ethenylbut-3-enoxy)-9H-fluorene?
The canonical SMILES for 1-(2-ethenylbut-3-enoxy)-9H-fluorene is C=CC(C=C)COc1cccc2c1Cc1ccccc1-2.
What is the InChIKey of 1-(2-ethenylbut-3-enoxy)-9H-fluorene?
The InChIKey is UMPWPIPISALCER-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18O/c1-3-14(4-2)13-20-19-11-7-10-17-16-9-6-5-8-15(16)12-18(17)19/h3-11,14H,1-2,12-13H2.
What are the key properties of 1-(2-ethenylbut-3-enoxy)-9H-fluorene?
1-(2-ethenylbut-3-enoxy)-9H-fluorene has a molecular weight of 262.35 g/mol, XLogP of 4.62, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethenylbut-3-enoxy)-9H-fluorene is sourced from PubChem (CID 68787919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).