butyl-methoxy-propylphosphane

C8H19OP — CID 150191747

IUPACbutyl-methoxy-propylphosphane
SMILESCCCCP(CCC)OC
InChIInChI=1S/C8H19OP/c1-4-6-8-10(9-3)7-5-2/h4-8H2,1-3H3
InChIKeyFNOVNTTWGPRBNQ-UHFFFAOYSA-N
MW162.21 g/mol
LogP3.24
Rot. Bonds6

About butyl-methoxy-propylphosphane

butyl-methoxy-propylphosphane (PubChem CID 150191747) has the molecular formula C8H19OP and a molecular weight of 162.21 g/mol. Its IUPAC name is butyl-methoxy-propylphosphane.

Molecular Properties

Compound Namebutyl-methoxy-propylphosphane
PubChem CID150191747
Molecular FormulaC8H19OP
Molecular Weight162.21 g/mol
Exact Mass162.12
IUPAC Namebutyl-methoxy-propylphosphane
SMILESCCCCP(CCC)OC
InChIInChI=1S/C8H19OP/c1-4-6-8-10(9-3)7-5-2/h4-8H2,1-3H3
InChIKeyFNOVNTTWGPRBNQ-UHFFFAOYSA-N
XLogP3.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.21
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze butyl-methoxy-propylphosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of butyl-methoxy-propylphosphane?
The IUPAC name of butyl-methoxy-propylphosphane (CID 150191747) is butyl-methoxy-propylphosphane.
What is the SMILES notation for butyl-methoxy-propylphosphane?
The canonical SMILES for butyl-methoxy-propylphosphane is CCCCP(CCC)OC.
What is the InChIKey of butyl-methoxy-propylphosphane?
The InChIKey is FNOVNTTWGPRBNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19OP/c1-4-6-8-10(9-3)7-5-2/h4-8H2,1-3H3.
What are the key properties of butyl-methoxy-propylphosphane?
butyl-methoxy-propylphosphane has a molecular weight of 162.21 g/mol, XLogP of 3.24, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-methoxy-propylphosphane is sourced from PubChem (CID 150191747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).