hex-1-enyl(diphenyl)phosphane

C18H21P — CID 71345520

IUPAChex-1-enyl(diphenyl)phosphane
SMILESCCCCC=CP(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H21P/c1-2-3-4-11-16-19(17-12-7-5-8-13-17)18-14-9-6-10-15-18/h5-16H,2-4H2,1H3
InChIKeyLNRXGPZISVQPAJ-UHFFFAOYSA-N
MW268.34 g/mol
LogP4.82
Rot. Bonds6

About hex-1-enyl(diphenyl)phosphane

hex-1-enyl(diphenyl)phosphane (PubChem CID 71345520) has the molecular formula C18H21P and a molecular weight of 268.34 g/mol. Its IUPAC name is hex-1-enyl(diphenyl)phosphane.

Molecular Properties

Compound Namehex-1-enyl(diphenyl)phosphane
PubChem CID71345520
Molecular FormulaC18H21P
Molecular Weight268.34 g/mol
Exact Mass268.14
IUPAC Namehex-1-enyl(diphenyl)phosphane
SMILESCCCCC=CP(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H21P/c1-2-3-4-11-16-19(17-12-7-5-8-13-17)18-14-9-6-10-15-18/h5-16H,2-4H2,1H3
InChIKeyLNRXGPZISVQPAJ-UHFFFAOYSA-N
XLogP4.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(Z)-3-diphenylphosphanyl-N,N-dimethylprop-2-en-1-amine
CID 14909100
CID 134934613
CID 134934613
[(3Z)-octa-1,3-dienyl]benzene
CID 154692518
hex-1-enylbenzene;prop-1-ene
CID 157442084
[(Z)-hept-2-enyl]-dimethyl-phenylsilane
CID 15915975
hex-1-enyl(phenyl)phosphane;dihydrochloride
CID 175399420
triphenyl-[(Z)-tetradec-7-enyl]phosphanium
CID 42631990
[(12E,24E,36E,48E,60E)-hexahexaconta-12,24,36,48,60-pentaenyl]-triphenylphosphanium
CID 10796462
[(Z)-hex-1-enyl]sulfinylbenzene
CID 11275798
[(1E,3E)-2-methylocta-1,3-dienyl]benzene
CID 15953217
[(E)-octadec-1-enyl]benzene
CID 22722345
[(E)-oct-2-enyl]benzene
CID 13383320

Frequently Asked Questions

What is the IUPAC name of hex-1-enyl(diphenyl)phosphane?
The IUPAC name of hex-1-enyl(diphenyl)phosphane (CID 71345520) is hex-1-enyl(diphenyl)phosphane.
What is the SMILES notation for hex-1-enyl(diphenyl)phosphane?
The canonical SMILES for hex-1-enyl(diphenyl)phosphane is CCCCC=CP(c1ccccc1)c1ccccc1.
What is the InChIKey of hex-1-enyl(diphenyl)phosphane?
The InChIKey is LNRXGPZISVQPAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21P/c1-2-3-4-11-16-19(17-12-7-5-8-13-17)18-14-9-6-10-15-18/h5-16H,2-4H2,1H3.
What are the key properties of hex-1-enyl(diphenyl)phosphane?
hex-1-enyl(diphenyl)phosphane has a molecular weight of 268.34 g/mol, XLogP of 4.82, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hex-1-enyl(diphenyl)phosphane is sourced from PubChem (CID 71345520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).