but-1-enyl(propyl)phosphane

C7H15P — CID 173167950

IUPACbut-1-enyl(propyl)phosphane
SMILESCCC=CPCCC
InChIInChI=1S/C7H15P/c1-3-5-7-8-6-4-2/h5,7-8H,3-4,6H2,1-2H3
InChIKeyMBUMUUKRPXQHTG-UHFFFAOYSA-N
MW130.17 g/mol
LogP3.00
Rot. Bonds4

About but-1-enyl(propyl)phosphane

but-1-enyl(propyl)phosphane (PubChem CID 173167950) has the molecular formula C7H15P and a molecular weight of 130.17 g/mol. Its IUPAC name is but-1-enyl(propyl)phosphane.

Molecular Properties

Compound Namebut-1-enyl(propyl)phosphane
PubChem CID173167950
Molecular FormulaC7H15P
Molecular Weight130.17 g/mol
Exact Mass130.09
IUPAC Namebut-1-enyl(propyl)phosphane
SMILESCCC=CPCCC
InChIInChI=1S/C7H15P/c1-3-5-7-8-6-4-2/h5,7-8H,3-4,6H2,1-2H3
InChIKeyMBUMUUKRPXQHTG-UHFFFAOYSA-N
XLogP3.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.17
LogP ≤ 53.00
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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Frequently Asked Questions

What is the IUPAC name of but-1-enyl(propyl)phosphane?
The IUPAC name of but-1-enyl(propyl)phosphane (CID 173167950) is but-1-enyl(propyl)phosphane.
What is the SMILES notation for but-1-enyl(propyl)phosphane?
The canonical SMILES for but-1-enyl(propyl)phosphane is CCC=CPCCC.
What is the InChIKey of but-1-enyl(propyl)phosphane?
The InChIKey is MBUMUUKRPXQHTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15P/c1-3-5-7-8-6-4-2/h5,7-8H,3-4,6H2,1-2H3.
What are the key properties of but-1-enyl(propyl)phosphane?
but-1-enyl(propyl)phosphane has a molecular weight of 130.17 g/mol, XLogP of 3.00, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for but-1-enyl(propyl)phosphane is sourced from PubChem (CID 173167950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).