2-silylpropane-1,2-diol

C3H10O2Si — CID 173442729

IUPAC2-silylpropane-1,2-diol
SMILESCC(O)([SiH3])CO
InChIInChI=1S/C3H10O2Si/c1-3(5,6)2-4/h4-5H,2H2,1,6H3
InChIKeyBQIKCHVRSPATTM-UHFFFAOYSA-N
MW106.20 g/mol
LogP-1.95
Rot. Bonds1

About 2-silylpropane-1,2-diol

2-silylpropane-1,2-diol (PubChem CID 173442729) has the molecular formula C3H10O2Si and a molecular weight of 106.20 g/mol. Its IUPAC name is 2-silylpropane-1,2-diol.

Molecular Properties

Compound Name2-silylpropane-1,2-diol
PubChem CID173442729
Molecular FormulaC3H10O2Si
Molecular Weight106.20 g/mol
Exact Mass106.05
IUPAC Name2-silylpropane-1,2-diol
SMILESCC(O)([SiH3])CO
InChIInChI=1S/C3H10O2Si/c1-3(5,6)2-4/h4-5H,2H2,1,6H3
InChIKeyBQIKCHVRSPATTM-UHFFFAOYSA-N
XLogP-1.95
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.20
LogP ≤ 5-1.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2S,3S)-2,3-dimethylbutane-1,2,3,4-tetrol
CID 130718714
2,3-dimethylbutane-1,2,3,4-tetrol
CID 130147728
(2S,3R,4R)-2,3,4,5-tetramethylhexane-1,2,3,4,5-pentol
CID 34085051
2,4-bis(hydroxymethyl)-3-methyl-3-(1,2,3-trihydroxypropan-2-yl)pentane-1,2,4,5-tetrol
CID 175345676
2-methylpropan-2-ol;propan-1-ol;yttrium
CID 154183382
2-(hydroxymethyl)-2-methylpropane-1,3-diol
CID 118432348
alumane;2,2-dimethylpropan-1-ol
CID 174479314
2-methyl-3-silylbutane-2,3-diol
CID 174482175
ethane-1,1,1,2-tetrol
CID 22259953
2,2-di(methyl)propan-1-ol
CID 135993184
azane;2-(hydroxymethyl)-2-methylpropane-1,3-diol
CID 88666778
2,2-bis(hydroxymethyl)propane-1,3-diol;2,2-dimethylpropane
CID 157350267

Frequently Asked Questions

What is the IUPAC name of 2-silylpropane-1,2-diol?
The IUPAC name of 2-silylpropane-1,2-diol (CID 173442729) is 2-silylpropane-1,2-diol.
What is the SMILES notation for 2-silylpropane-1,2-diol?
The canonical SMILES for 2-silylpropane-1,2-diol is CC(O)([SiH3])CO.
What is the InChIKey of 2-silylpropane-1,2-diol?
The InChIKey is BQIKCHVRSPATTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10O2Si/c1-3(5,6)2-4/h4-5H,2H2,1,6H3.
What are the key properties of 2-silylpropane-1,2-diol?
2-silylpropane-1,2-diol has a molecular weight of 106.20 g/mol, XLogP of -1.95, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-silylpropane-1,2-diol is sourced from PubChem (CID 173442729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).