4,4-dimethyl-3-silylpentan-1-ol

C7H18OSi — CID 175474328

IUPAC4,4-dimethyl-3-silylpentan-1-ol
SMILESCC(C)(C)C([SiH3])CCO
InChIInChI=1S/C7H18OSi/c1-7(2,3)6(9)4-5-8/h6,8H,4-5H2,1-3,9H3
InChIKeyUEZIKNVNGMAZFK-UHFFFAOYSA-N
MW146.31 g/mol
LogP0.57
Rot. Bonds2

About 4,4-dimethyl-3-silylpentan-1-ol

4,4-dimethyl-3-silylpentan-1-ol (PubChem CID 175474328) has the molecular formula C7H18OSi and a molecular weight of 146.31 g/mol. Its IUPAC name is 4,4-dimethyl-3-silylpentan-1-ol.

Molecular Properties

Compound Name4,4-dimethyl-3-silylpentan-1-ol
PubChem CID175474328
Molecular FormulaC7H18OSi
Molecular Weight146.31 g/mol
Exact Mass146.11
IUPAC Name4,4-dimethyl-3-silylpentan-1-ol
SMILESCC(C)(C)C([SiH3])CCO
InChIInChI=1S/C7H18OSi/c1-7(2,3)6(9)4-5-8/h6,8H,4-5H2,1-3,9H3
InChIKeyUEZIKNVNGMAZFK-UHFFFAOYSA-N
XLogP0.57
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.31
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3,4-ditert-butylhexane-1,6-diol
CID 174460247
(3S)-3,4,4-trimethylpentan-1-ol
CID 124507131
(3S,4S,6S)-7,7-dimethyloctane-1,3,4,5,6-pentol
CID 89370097
4-methyl-3-propan-2-ylpentan-1-ol
CID 20683771
3,6,6-trimethylheptane-1,5-diol
CID 78070326
(3R)-3-(3,3-dimethylbutan-2-ylamino)butan-1-ol
CID 103871778
3-amino-4-methylpentane-1,4-diol
CID 58522169
(3R)-4-amino-3,4-dimethylpentan-1-ol
CID 97030968
2,2,3-trimethylpentane-1,5-diol
CID 57197180
4-methyl-3-sulfanylpentane-1,4-diol
CID 12674045
3-(ethylamino)-5-methoxy-5-methylhexan-1-ol
CID 106676516
3-(2,2-dimethylpropylamino)-4,4-dimethylpentan-1-ol
CID 106348997

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-3-silylpentan-1-ol?
The IUPAC name of 4,4-dimethyl-3-silylpentan-1-ol (CID 175474328) is 4,4-dimethyl-3-silylpentan-1-ol.
What is the SMILES notation for 4,4-dimethyl-3-silylpentan-1-ol?
The canonical SMILES for 4,4-dimethyl-3-silylpentan-1-ol is CC(C)(C)C([SiH3])CCO.
What is the InChIKey of 4,4-dimethyl-3-silylpentan-1-ol?
The InChIKey is UEZIKNVNGMAZFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18OSi/c1-7(2,3)6(9)4-5-8/h6,8H,4-5H2,1-3,9H3.
What are the key properties of 4,4-dimethyl-3-silylpentan-1-ol?
4,4-dimethyl-3-silylpentan-1-ol has a molecular weight of 146.31 g/mol, XLogP of 0.57, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-3-silylpentan-1-ol is sourced from PubChem (CID 175474328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).