hexyl(dimethyl)phosphane

C8H19P — CID 18386879

IUPAChexyl(dimethyl)phosphane
SMILESCCCCCCP(C)C
InChIInChI=1S/C8H19P/c1-4-5-6-7-8-9(2)3/h4-8H2,1-3H3
InChIKeyAAWKVSBCMBPJPP-UHFFFAOYSA-N
MW146.21 g/mol
LogP3.31
Rot. Bonds5

About hexyl(dimethyl)phosphane

hexyl(dimethyl)phosphane (PubChem CID 18386879) has the molecular formula C8H19P and a molecular weight of 146.21 g/mol. Its IUPAC name is hexyl(dimethyl)phosphane.

Molecular Properties

Compound Namehexyl(dimethyl)phosphane
PubChem CID18386879
Molecular FormulaC8H19P
Molecular Weight146.21 g/mol
Exact Mass146.12
IUPAC Namehexyl(dimethyl)phosphane
SMILESCCCCCCP(C)C
InChIInChI=1S/C8H19P/c1-4-5-6-7-8-9(2)3/h4-8H2,1-3H3
InChIKeyAAWKVSBCMBPJPP-UHFFFAOYSA-N
XLogP3.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 53.31
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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Related Compounds

Tributylphosphine
CID 13831
Triisopropylphosphine
CID 80969
Phosphine sulfide, butyldipentyl-
CID 99399
Phosphine oxide, dibutylhexyl-
CID 99403
Phosphine oxide, dihexylmethyl-
CID 99409
Tributylhexylphosphonium Bromide
CID 22712793
Tripropylphosphine
CID 75226
Trihexylphosphine
CID 77831
Di-tert-butylcyclohexylphosphine
CID 4643321
Tributyl(hexyl)phosphanium chloride
CID 23317382
Decyltrimethylphosphonium chloride
CID 76315520
Tributyl(hexyl)phosphanium iodide
CID 86107567

Frequently Asked Questions

What is the IUPAC name of hexyl(dimethyl)phosphane?
The IUPAC name of hexyl(dimethyl)phosphane (CID 18386879) is hexyl(dimethyl)phosphane.
What is the SMILES notation for hexyl(dimethyl)phosphane?
The canonical SMILES for hexyl(dimethyl)phosphane is CCCCCCP(C)C.
What is the InChIKey of hexyl(dimethyl)phosphane?
The InChIKey is AAWKVSBCMBPJPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19P/c1-4-5-6-7-8-9(2)3/h4-8H2,1-3H3.
What are the key properties of hexyl(dimethyl)phosphane?
hexyl(dimethyl)phosphane has a molecular weight of 146.21 g/mol, XLogP of 3.31, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexyl(dimethyl)phosphane is sourced from PubChem (CID 18386879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).