butyl-methyl-phenylphosphane

C11H17P — CID 14832966

IUPACbutyl-methyl-phenylphosphane
SMILESCCCCP(C)c1ccccc1
InChIInChI=1S/C11H17P/c1-3-4-10-12(2)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
InChIKeyGHSJQOGVLZRRPF-UHFFFAOYSA-N
MW180.23 g/mol
LogP3.22
Rot. Bonds4

About butyl-methyl-phenylphosphane

butyl-methyl-phenylphosphane (PubChem CID 14832966) has the molecular formula C11H17P and a molecular weight of 180.23 g/mol. Its IUPAC name is butyl-methyl-phenylphosphane.

Molecular Properties

Compound Namebutyl-methyl-phenylphosphane
PubChem CID14832966
Molecular FormulaC11H17P
Molecular Weight180.23 g/mol
Exact Mass180.11
IUPAC Namebutyl-methyl-phenylphosphane
SMILESCCCCP(C)c1ccccc1
InChIInChI=1S/C11H17P/c1-3-4-10-12(2)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
InChIKeyGHSJQOGVLZRRPF-UHFFFAOYSA-N
XLogP3.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze butyl-methyl-phenylphosphane with MolForge

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

Launch Full Analysis

Related Compounds

bis[3-[methyl(phenyl)phosphanyl]propyl]-phenylphosphane
CID 58654516
(S)-ethyl-methyl-phenylphosphane
CID 10909914
butyl-phenyl-trimethylsilylphosphane
CID 15076364
butyl(diphenyl)phosphane;chloroplatinum
CID 175284434
dipentyl(phenyl)phosphane
CID 3085487
magnesium;butyl-tert-butyl-phenylphosphane;dichloride
CID 174942565
butyl-phenoxy-phenylphosphane
CID 90719182
3-[methyl(phenyl)phosphanyl]propanenitrile
CID 86160293
hexadecyl(phenyl)phosphinous acid
CID 22292084
benzyl-butyl-ethylphosphane
CID 54234955
butane;triphenylphosphane
CID 161447439
dichloronickel;bis(diphenyl(propyl)phosphane)
CID 87129784

Frequently Asked Questions

What is the IUPAC name of butyl-methyl-phenylphosphane?
The IUPAC name of butyl-methyl-phenylphosphane (CID 14832966) is butyl-methyl-phenylphosphane.
What is the SMILES notation for butyl-methyl-phenylphosphane?
The canonical SMILES for butyl-methyl-phenylphosphane is CCCCP(C)c1ccccc1.
What is the InChIKey of butyl-methyl-phenylphosphane?
The InChIKey is GHSJQOGVLZRRPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17P/c1-3-4-10-12(2)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3.
What are the key properties of butyl-methyl-phenylphosphane?
butyl-methyl-phenylphosphane has a molecular weight of 180.23 g/mol, XLogP of 3.22, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-methyl-phenylphosphane is sourced from PubChem (CID 14832966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).