3,3-dimethylpentan-2-yl(methyl)phosphane

C8H19P — CID 123328207

IUPAC3,3-dimethylpentan-2-yl(methyl)phosphane
SMILESCCC(C)(C)C(C)PC
InChIInChI=1S/C8H19P/c1-6-8(3,4)7(2)9-5/h7,9H,6H2,1-5H3
InChIKeyXOKSQWQIHNSKHC-UHFFFAOYSA-N
MW146.21 g/mol
LogP3.12
Rot. Bonds3

About 3,3-dimethylpentan-2-yl(methyl)phosphane

3,3-dimethylpentan-2-yl(methyl)phosphane (PubChem CID 123328207) has the molecular formula C8H19P and a molecular weight of 146.21 g/mol. Its IUPAC name is 3,3-dimethylpentan-2-yl(methyl)phosphane.

Molecular Properties

Compound Name3,3-dimethylpentan-2-yl(methyl)phosphane
PubChem CID123328207
Molecular FormulaC8H19P
Molecular Weight146.21 g/mol
Exact Mass146.12
IUPAC Name3,3-dimethylpentan-2-yl(methyl)phosphane
SMILESCCC(C)(C)C(C)PC
InChIInChI=1S/C8H19P/c1-6-8(3,4)7(2)9-5/h7,9H,6H2,1-5H3
InChIKeyXOKSQWQIHNSKHC-UHFFFAOYSA-N
XLogP3.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.21
LogP ≤ 53.12
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

2,2-dimethylbutane;propane;2,3,3-trimethylpentane
CID 91438439
N,3,4,4-tetramethylhexan-1-amine
CID 138576801
ethane;hexane;2,3,3-trimethylpentane
CID 143714855
2,5,5-trimethylheptan-4-amine
CID 115782662
(2R)-2-hydroxy-3,3-dimethylpentanamide
CID 126746768
2,2,3,5,5-pentamethylheptan-4-ol
CID 156689812
4,4-dimethylhexane-3-thiol
CID 142722688
4,5,5-trimethylheptylcyclopropane
CID 123484430
2,4,4-trimethylhexan-3-ylhydrazine
CID 105281793
3,3-dimethylpentan-2-yl(dimethoxy)silane
CID 173004269
2,3,5,6,7,7-hexamethylnonane
CID 123984490
N-ethyl-2,4,4-trimethylhexan-3-amine
CID 114978547

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethylpentan-2-yl(methyl)phosphane?
The IUPAC name of 3,3-dimethylpentan-2-yl(methyl)phosphane (CID 123328207) is 3,3-dimethylpentan-2-yl(methyl)phosphane.
What is the SMILES notation for 3,3-dimethylpentan-2-yl(methyl)phosphane?
The canonical SMILES for 3,3-dimethylpentan-2-yl(methyl)phosphane is CCC(C)(C)C(C)PC.
What is the InChIKey of 3,3-dimethylpentan-2-yl(methyl)phosphane?
The InChIKey is XOKSQWQIHNSKHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19P/c1-6-8(3,4)7(2)9-5/h7,9H,6H2,1-5H3.
What are the key properties of 3,3-dimethylpentan-2-yl(methyl)phosphane?
3,3-dimethylpentan-2-yl(methyl)phosphane has a molecular weight of 146.21 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethylpentan-2-yl(methyl)phosphane is sourced from PubChem (CID 123328207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).