[(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium

C11H20O2P+ — CID 11816766

IUPAC[(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium
SMILESCCO[P+](=O)/C(C)=C/C1CCCCC1
InChIInChI=1S/C11H20O2P/c1-3-13-14(12)10(2)9-11-7-5-4-6-8-11/h9,11H,3-8H2,1-2H3/q+1/b10-9+
InChIKeyCGSQYPKJHJMTHW-MDZDMXLPSA-N
MW215.25 g/mol
LogP4.25
Rot. Bonds4

About [(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium

[(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium (PubChem CID 11816766) has the molecular formula C11H20O2P+ and a molecular weight of 215.25 g/mol. Its IUPAC name is [(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium.

Molecular Properties

Compound Name[(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium
PubChem CID11816766
Molecular FormulaC11H20O2P+
Molecular Weight215.25 g/mol
Exact Mass215.12
IUPAC Name[(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium
SMILESCCO[P+](=O)/C(C)=C/C1CCCCC1
InChIInChI=1S/C11H20O2P/c1-3-13-14(12)10(2)9-11-7-5-4-6-8-11/h9,11H,3-8H2,1-2H3/q+1/b10-9+
InChIKeyCGSQYPKJHJMTHW-MDZDMXLPSA-N
XLogP4.25
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Diethyl (R)-(1,1-difluoro-3-(4-methylcyclohex-3-en-1-yl)but-3-en-1-yl)phosphonate
CID 168720251
5,5-Bis(diethoxyphosphoryl)bicyclo[2.2.2]oct-2-ene
CID 12142924
(6S)-9-diethoxyphosphoryl-9-fluoro-2,6-dimethylnon-2-ene
CID 101149178
Diethyl[2-methyl-5-(propan-2-yl)cyclohex-2-en-1-yl]phosphonate
CID 277402
1-(Diethoxyphosphorylmethyl)cyclohexene
CID 11096460
[(E)-3-cyclohexylbut-2-enyl] diethyl phosphate
CID 11403548
[(E)-3-cyclohexylprop-2-enyl] diethyl phosphate
CID 11460071
diethyl (E)-(2-cyclohexylvinyl)phosphonate
CID 14493786
[(E)-2-di(propan-2-yloxy)phosphorylethenyl]cyclohexane
CID 101157518
(Z)-5-diethoxyphosphoryl-3-methylnon-4-ene
CID 101401800
[(Z)-3-cyclohexylprop-2-enyl] diethyl phosphate
CID 102246290
Dibutyl 2-methyl-3-cyclohexenylphosphonate
CID 129813652

Frequently Asked Questions

What is the IUPAC name of [(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium?
The IUPAC name of [(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium (CID 11816766) is [(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium.
What is the SMILES notation for [(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium?
The canonical SMILES for [(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium is CCO[P+](=O)/C(C)=C/C1CCCCC1.
What is the InChIKey of [(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium?
The InChIKey is CGSQYPKJHJMTHW-MDZDMXLPSA-N. The full InChI is InChI=1S/C11H20O2P/c1-3-13-14(12)10(2)9-11-7-5-4-6-8-11/h9,11H,3-8H2,1-2H3/q+1/b10-9+.
What are the key properties of [(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium?
[(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium has a molecular weight of 215.25 g/mol, XLogP of 4.25, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-1-cyclohexylprop-1-en-2-yl]-ethoxy-oxophosphanium is sourced from PubChem (CID 11816766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).