dicyclohexyl(5-methylhex-2-enyl)phosphane

C19H35P — CID 141408948

IUPACdicyclohexyl(5-methylhex-2-enyl)phosphane
SMILESCC(C)CC=CCP(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C19H35P/c1-17(2)11-9-10-16-20(18-12-5-3-6-13-18)19-14-7-4-8-15-19/h9-10,17-19H,3-8,11-16H2,1-2H3
InChIKeySVLIEKRZOVTCBE-UHFFFAOYSA-N
MW294.46 g/mol
LogP6.74
Rot. Bonds6

About dicyclohexyl(5-methylhex-2-enyl)phosphane

dicyclohexyl(5-methylhex-2-enyl)phosphane (PubChem CID 141408948) has the molecular formula C19H35P and a molecular weight of 294.46 g/mol. Its IUPAC name is dicyclohexyl(5-methylhex-2-enyl)phosphane.

Molecular Properties

Compound Namedicyclohexyl(5-methylhex-2-enyl)phosphane
PubChem CID141408948
Molecular FormulaC19H35P
Molecular Weight294.46 g/mol
Exact Mass294.25
IUPAC Namedicyclohexyl(5-methylhex-2-enyl)phosphane
SMILESCC(C)CC=CCP(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C19H35P/c1-17(2)11-9-10-16-20(18-12-5-3-6-13-18)19-14-7-4-8-15-19/h9-10,17-19H,3-8,11-16H2,1-2H3
InChIKeySVLIEKRZOVTCBE-UHFFFAOYSA-N
XLogP6.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.46
LogP ≤ 56.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dicyclohexyl(5-methylhex-2-enyl)phosphane?
The IUPAC name of dicyclohexyl(5-methylhex-2-enyl)phosphane (CID 141408948) is dicyclohexyl(5-methylhex-2-enyl)phosphane.
What is the SMILES notation for dicyclohexyl(5-methylhex-2-enyl)phosphane?
The canonical SMILES for dicyclohexyl(5-methylhex-2-enyl)phosphane is CC(C)CC=CCP(C1CCCCC1)C1CCCCC1.
What is the InChIKey of dicyclohexyl(5-methylhex-2-enyl)phosphane?
The InChIKey is SVLIEKRZOVTCBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35P/c1-17(2)11-9-10-16-20(18-12-5-3-6-13-18)19-14-7-4-8-15-19/h9-10,17-19H,3-8,11-16H2,1-2H3.
What are the key properties of dicyclohexyl(5-methylhex-2-enyl)phosphane?
dicyclohexyl(5-methylhex-2-enyl)phosphane has a molecular weight of 294.46 g/mol, XLogP of 6.74, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dicyclohexyl(5-methylhex-2-enyl)phosphane is sourced from PubChem (CID 141408948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).