ethane;ethenol;9-ethyl-9H-fluorene

C19H24O — CID 142934939

IUPACethane;ethenol;9-ethyl-9H-fluorene
SMILESC=CO.CC.CCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C15H14.C2H4O.C2H6/c1-2-11-12-7-3-5-9-14(12)15-10-6-4-8-13(11)15;1-2-3;1-2/h3-11H,2H2,1H3;2-3H,1H2;1-2H3
InChIKeyGDALHBBHNCJKID-UHFFFAOYSA-N
MW268.40 g/mol
LogP5.92
Rot. Bonds1

About ethane;ethenol;9-ethyl-9H-fluorene

ethane;ethenol;9-ethyl-9H-fluorene (PubChem CID 142934939) has the molecular formula C19H24O and a molecular weight of 268.40 g/mol. Its IUPAC name is ethane;ethenol;9-ethyl-9H-fluorene.

Molecular Properties

Compound Nameethane;ethenol;9-ethyl-9H-fluorene
PubChem CID142934939
Molecular FormulaC19H24O
Molecular Weight268.40 g/mol
Exact Mass268.18
IUPAC Nameethane;ethenol;9-ethyl-9H-fluorene
SMILESC=CO.CC.CCC1c2ccccc2-c2ccccc21
InChIInChI=1S/C15H14.C2H4O.C2H6/c1-2-11-12-7-3-5-9-14(12)15-10-6-4-8-13(11)15;1-2-3;1-2/h3-11H,2H2,1H3;2-3H,1H2;1-2H3
InChIKeyGDALHBBHNCJKID-UHFFFAOYSA-N
XLogP5.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.40
LogP ≤ 55.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethane;ethenol;9-ethyl-9H-fluorene?
The IUPAC name of ethane;ethenol;9-ethyl-9H-fluorene (CID 142934939) is ethane;ethenol;9-ethyl-9H-fluorene.
What is the SMILES notation for ethane;ethenol;9-ethyl-9H-fluorene?
The canonical SMILES for ethane;ethenol;9-ethyl-9H-fluorene is C=CO.CC.CCC1c2ccccc2-c2ccccc21.
What is the InChIKey of ethane;ethenol;9-ethyl-9H-fluorene?
The InChIKey is GDALHBBHNCJKID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14.C2H4O.C2H6/c1-2-11-12-7-3-5-9-14(12)15-10-6-4-8-13(11)15;1-2-3;1-2/h3-11H,2H2,1H3;2-3H,1H2;1-2H3.
What are the key properties of ethane;ethenol;9-ethyl-9H-fluorene?
ethane;ethenol;9-ethyl-9H-fluorene has a molecular weight of 268.40 g/mol, XLogP of 5.92, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;ethenol;9-ethyl-9H-fluorene is sourced from PubChem (CID 142934939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).