(1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol

C7H18O3Si — CID 130927420

IUPAC(1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol
SMILESC[C@](O)(CO)[C@H](O)[Si](C)(C)C
InChIInChI=1S/C7H18O3Si/c1-7(10,5-8)6(9)11(2,3)4/h6,8-10H,5H2,1-4H3/t6-,7+/m1/s1
InChIKeyDNFNZZAUCLKLHK-RQJHMYQMSA-N
MW178.30 g/mol
LogP-0.03
Rot. Bonds3

About (1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol

(1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol (PubChem CID 130927420) has the molecular formula C7H18O3Si and a molecular weight of 178.30 g/mol. Its IUPAC name is (1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol.

Molecular Properties

Compound Name(1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol
PubChem CID130927420
Molecular FormulaC7H18O3Si
Molecular Weight178.30 g/mol
Exact Mass178.10
IUPAC Name(1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol
SMILESC[C@](O)(CO)[C@H](O)[Si](C)(C)C
InChIInChI=1S/C7H18O3Si/c1-7(10,5-8)6(9)11(2,3)4/h6,8-10H,5H2,1-4H3/t6-,7+/m1/s1
InChIKeyDNFNZZAUCLKLHK-RQJHMYQMSA-N
XLogP-0.03
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.30
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-((Tert-butyldimethylsilyl)oxy)-2-methylpropan-1-ol
CID 57929973
2-([tert-Butyl(dimethyl)silyl]oxy)propan-1-ol
CID 15688070
2-Methyl-2-triethylsilylperoxypropan-1-ol
CID 11160350
(2R)-3-{[tert-Butyl(dimethyl)silyl]oxy}propane-1,2-diol
CID 13552567
(S)-2-(tert-Butyl-dimethyl-silanyloxy)-propan-1-ol
CID 15688069
Tris-(trimethylsilyl)-glycerol
CID 22022602
(2S,3R)-3-[tert-butyl(dimethyl)silyl]oxybutan-2-ol
CID 58012744
Tms-glycerol
CID 85144634
(2S)-3-[tert-butyl(dimethyl)silyl]oxypropane-1,2-diol
CID 100997878
tms-Propylenglykol
CID 129636019
(R)-3-Fluoro-2-methyl-2-((triethylsilyl)oxy)propan-1-ol
CID 165380691
3-(Trimethylsilyl)-1,2-propanediol
CID 4105497

Frequently Asked Questions

What is the IUPAC name of (1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol?
The IUPAC name of (1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol (CID 130927420) is (1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol.
What is the SMILES notation for (1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol?
The canonical SMILES for (1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol is C[C@](O)(CO)[C@H](O)[Si](C)(C)C.
What is the InChIKey of (1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol?
The InChIKey is DNFNZZAUCLKLHK-RQJHMYQMSA-N. The full InChI is InChI=1S/C7H18O3Si/c1-7(10,5-8)6(9)11(2,3)4/h6,8-10H,5H2,1-4H3/t6-,7+/m1/s1.
What are the key properties of (1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol?
(1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol has a molecular weight of 178.30 g/mol, XLogP of -0.03, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S)-2-methyl-1-trimethylsilylpropane-1,2,3-triol is sourced from PubChem (CID 130927420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).