3-methylphosphanylpropan-1-ol

C4H11OP — CID 57224781

IUPAC3-methylphosphanylpropan-1-ol
SMILESCPCCCO
InChIInChI=1S/C4H11OP/c1-6-4-2-3-5/h5-6H,2-4H2,1H3
InChIKeyDTZVOGXAUYAKSZ-UHFFFAOYSA-N
MW106.11 g/mol
LogP0.68
Rot. Bonds3

About 3-methylphosphanylpropan-1-ol

3-methylphosphanylpropan-1-ol (PubChem CID 57224781) has the molecular formula C4H11OP and a molecular weight of 106.11 g/mol. Its IUPAC name is 3-methylphosphanylpropan-1-ol.

Molecular Properties

Compound Name3-methylphosphanylpropan-1-ol
PubChem CID57224781
Molecular FormulaC4H11OP
Molecular Weight106.11 g/mol
Exact Mass106.05
IUPAC Name3-methylphosphanylpropan-1-ol
SMILESCPCCCO
InChIInChI=1S/C4H11OP/c1-6-4-2-3-5/h5-6H,2-4H2,1H3
InChIKeyDTZVOGXAUYAKSZ-UHFFFAOYSA-N
XLogP0.68
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.11
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

2-methylphosphanylethanol
CID 21363171
butane;butane-1,4-diol
CID 160786697
3-[[[dimethyl(3-methylphosphanylpropyl)silyl]methyl-dimethylsilyl]oxy-dimethylsilyl]propan-1-ol
CID 123228449
methanediol;pentane-1,5-diol
CID 90027781
butane;butan-1-ol
CID 19774960
methyl(nonyl)phosphane;thulium
CID 87745413
hexane-1,6-diol;octane-1,8-diol
CID 21202869
pentadecane-1,15-diol
CID 518994
tricosane-1,23-diol
CID 25144332
CID 157146691
CID 157146691
butane-1,4-diol;zinc
CID 170696072
trioctacontane-1,83-diol
CID 87526146

Frequently Asked Questions

What is the IUPAC name of 3-methylphosphanylpropan-1-ol?
The IUPAC name of 3-methylphosphanylpropan-1-ol (CID 57224781) is 3-methylphosphanylpropan-1-ol.
What is the SMILES notation for 3-methylphosphanylpropan-1-ol?
The canonical SMILES for 3-methylphosphanylpropan-1-ol is CPCCCO.
What is the InChIKey of 3-methylphosphanylpropan-1-ol?
The InChIKey is DTZVOGXAUYAKSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11OP/c1-6-4-2-3-5/h5-6H,2-4H2,1H3.
What are the key properties of 3-methylphosphanylpropan-1-ol?
3-methylphosphanylpropan-1-ol has a molecular weight of 106.11 g/mol, XLogP of 0.68, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylphosphanylpropan-1-ol is sourced from PubChem (CID 57224781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).