dipropylphosphane

C6H15P — CID 12057559

IUPACdipropylphosphane
SMILESCCCPCCC
InChIInChI=1S/C6H15P/c1-3-5-7-6-4-2/h7H,3-6H2,1-2H3
InChIKeyMTWCVKTUVWXLFS-UHFFFAOYSA-N
MW118.16 g/mol
LogP2.48
Rot. Bonds4

About dipropylphosphane

dipropylphosphane (PubChem CID 12057559) has the molecular formula C6H15P and a molecular weight of 118.16 g/mol. Its IUPAC name is dipropylphosphane.

Molecular Properties

Compound Namedipropylphosphane
PubChem CID12057559
Molecular FormulaC6H15P
Molecular Weight118.16 g/mol
Exact Mass118.09
IUPAC Namedipropylphosphane
SMILESCCCPCCC
InChIInChI=1S/C6H15P/c1-3-5-7-6-4-2/h7H,3-6H2,1-2H3
InChIKeyMTWCVKTUVWXLFS-UHFFFAOYSA-N
XLogP2.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.16
LogP ≤ 52.48
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 dipropylphosphane?
The IUPAC name of dipropylphosphane (CID 12057559) is dipropylphosphane.
What is the SMILES notation for dipropylphosphane?
The canonical SMILES for dipropylphosphane is CCCPCCC.
What is the InChIKey of dipropylphosphane?
The InChIKey is MTWCVKTUVWXLFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15P/c1-3-5-7-6-4-2/h7H,3-6H2,1-2H3.
What are the key properties of dipropylphosphane?
dipropylphosphane has a molecular weight of 118.16 g/mol, XLogP of 2.48, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dipropylphosphane is sourced from PubChem (CID 12057559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).