tris(3-methylbutyl)phosphane

C15H33P — CID 14324804

IUPACtris(3-methylbutyl)phosphane
SMILESCC(C)CCP(CCC(C)C)CCC(C)C
InChIInChI=1S/C15H33P/c1-13(2)7-10-16(11-8-14(3)4)12-9-15(5)6/h13-15H,7-12H2,1-6H3
InChIKeyLAIHWQOLDGBKFT-UHFFFAOYSA-N
MW244.40 g/mol
LogP5.61
Rot. Bonds9

About tris(3-methylbutyl)phosphane

tris(3-methylbutyl)phosphane (PubChem CID 14324804) has the molecular formula C15H33P and a molecular weight of 244.40 g/mol. Its IUPAC name is tris(3-methylbutyl)phosphane.

Molecular Properties

Compound Nametris(3-methylbutyl)phosphane
PubChem CID14324804
Molecular FormulaC15H33P
Molecular Weight244.40 g/mol
Exact Mass244.23
IUPAC Nametris(3-methylbutyl)phosphane
SMILESCC(C)CCP(CCC(C)C)CCC(C)C
InChIInChI=1S/C15H33P/c1-13(2)7-10-16(11-8-14(3)4)12-9-15(5)6/h13-15H,7-12H2,1-6H3
InChIKeyLAIHWQOLDGBKFT-UHFFFAOYSA-N
XLogP5.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500244.40
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

tris(7-methyloctyl)phosphane
CID 141083422
tris(6-methylheptyl)phosphane
CID 14029657
3-methylbutylphosphonous acid
CID 23313254
tris[2-di(propan-2-yl)phosphanylethyl]phosphane
CID 102285026
4-methylpentane-1,1-diamine;dihydrochloride
CID 87818690
methyl-[2-[methyl(4-methylpentyl)phosphanyl]ethyl]-(4-methylpentyl)phosphane;dihydrobromide
CID 173222555
2-methylpentane
CID 7892
2,8-dimethyl-5-(3-methylbutyl)nonane
CID 57230829
2,9-dimethyl-5,6-bis(3-methylbutyl)decane
CID 139994880
2,22-dimethyltricosane
CID 58100191
2,9-dimethyldecane;2,11-dimethyldodecane;2,8-dimethylnonane;2,7-dimethyloctane;2,10-dimethylundecane
CID 161261647
dibutyl(3-methyltetradecyl)phosphane
CID 174745432

Frequently Asked Questions

What is the IUPAC name of tris(3-methylbutyl)phosphane?
The IUPAC name of tris(3-methylbutyl)phosphane (CID 14324804) is tris(3-methylbutyl)phosphane.
What is the SMILES notation for tris(3-methylbutyl)phosphane?
The canonical SMILES for tris(3-methylbutyl)phosphane is CC(C)CCP(CCC(C)C)CCC(C)C.
What is the InChIKey of tris(3-methylbutyl)phosphane?
The InChIKey is LAIHWQOLDGBKFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33P/c1-13(2)7-10-16(11-8-14(3)4)12-9-15(5)6/h13-15H,7-12H2,1-6H3.
What are the key properties of tris(3-methylbutyl)phosphane?
tris(3-methylbutyl)phosphane has a molecular weight of 244.40 g/mol, XLogP of 5.61, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tris(3-methylbutyl)phosphane is sourced from PubChem (CID 14324804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).