2,3-dimethylbutoxyphosphane

C6H15OP — CID 151975112

IUPAC2,3-dimethylbutoxyphosphane
SMILESCC(C)C(C)COP
InChIInChI=1S/C6H15OP/c1-5(2)6(3)4-7-8/h5-6H,4,8H2,1-3H3
InChIKeyBZGTWASXNMNUMO-UHFFFAOYSA-N
MW134.16 g/mol
LogP2.09
Rot. Bonds3

About 2,3-dimethylbutoxyphosphane

2,3-dimethylbutoxyphosphane (PubChem CID 151975112) has the molecular formula C6H15OP and a molecular weight of 134.16 g/mol. Its IUPAC name is 2,3-dimethylbutoxyphosphane.

Molecular Properties

Compound Name2,3-dimethylbutoxyphosphane
PubChem CID151975112
Molecular FormulaC6H15OP
Molecular Weight134.16 g/mol
Exact Mass134.09
IUPAC Name2,3-dimethylbutoxyphosphane
SMILESCC(C)C(C)COP
InChIInChI=1S/C6H15OP/c1-5(2)6(3)4-7-8/h5-6H,4,8H2,1-3H3
InChIKeyBZGTWASXNMNUMO-UHFFFAOYSA-N
XLogP2.09
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.16
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2R,3S)-2-methyl-4-phosphanyloxybutane-1,3-diol
CID 89333114
2,3-dimethylbutoxymethanol
CID 158248678
(3-methyl-2-propylpentoxy)phosphane
CID 123507297
2-[1-[1-(1-phosphanyloxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]propoxyphosphane
CID 59288681
2,4,4-trimethylpentoxyphosphane
CID 140992070
2,3-dimethylpentane;ethane;methane
CID 143379754
(4S)-2,3,4-trimethylhexane
CID 58359072
bis(2,3-dimethylpentane);tetrakis(2-methylbutane)
CID 158387932
(3R,5R)-2,3,5,6-tetramethylheptane
CID 102426642
1-(2,3-dimethylbutoxy)-4-methylpentane
CID 157134146
2,3-dimethylbutane;2,3-dimethylpentane;methanethiol
CID 171505915
cyclobutane;2,3-dimethylpentane
CID 145154125

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylbutoxyphosphane?
The IUPAC name of 2,3-dimethylbutoxyphosphane (CID 151975112) is 2,3-dimethylbutoxyphosphane.
What is the SMILES notation for 2,3-dimethylbutoxyphosphane?
The canonical SMILES for 2,3-dimethylbutoxyphosphane is CC(C)C(C)COP.
What is the InChIKey of 2,3-dimethylbutoxyphosphane?
The InChIKey is BZGTWASXNMNUMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15OP/c1-5(2)6(3)4-7-8/h5-6H,4,8H2,1-3H3.
What are the key properties of 2,3-dimethylbutoxyphosphane?
2,3-dimethylbutoxyphosphane has a molecular weight of 134.16 g/mol, XLogP of 2.09, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylbutoxyphosphane is sourced from PubChem (CID 151975112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).