5-[hydroxy(dimethyl)silyl]pentane-1,2-diol

C7H18O3Si — CID 45118377

IUPAC5-[hydroxy(dimethyl)silyl]pentane-1,2-diol
SMILESC[Si](C)(O)CCCC(O)CO
InChIInChI=1S/C7H18O3Si/c1-11(2,10)5-3-4-7(9)6-8/h7-10H,3-6H2,1-2H3
InChIKeyBWEVTSLYSDAXMH-UHFFFAOYSA-N
MW178.30 g/mol
LogP0.32
Rot. Bonds5

About 5-[hydroxy(dimethyl)silyl]pentane-1,2-diol

5-[hydroxy(dimethyl)silyl]pentane-1,2-diol (PubChem CID 45118377) has the molecular formula C7H18O3Si and a molecular weight of 178.30 g/mol. Its IUPAC name is 5-[hydroxy(dimethyl)silyl]pentane-1,2-diol.

Molecular Properties

Compound Name5-[hydroxy(dimethyl)silyl]pentane-1,2-diol
PubChem CID45118377
Molecular FormulaC7H18O3Si
Molecular Weight178.30 g/mol
Exact Mass178.10
IUPAC Name5-[hydroxy(dimethyl)silyl]pentane-1,2-diol
SMILESC[Si](C)(O)CCCC(O)CO
InChIInChI=1S/C7H18O3Si/c1-11(2,10)5-3-4-7(9)6-8/h7-10H,3-6H2,1-2H3
InChIKeyBWEVTSLYSDAXMH-UHFFFAOYSA-N
XLogP0.32
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.30
LogP ≤ 50.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

dodecane-1,2,11,12-tetrol
CID 71392430
(2R)-nonadecane-1,2-diol
CID 124511707
(2R)-octane-1,2-diol
CID 6994435
(2R)-decane-1,2-diol
CID 10888425
triacontane-1,2-diol
CID 19770548
(2S)-24-methylpentacosane-1,2-diol
CID 162845743
octane-1,2-diol
CID 159791136
decane-1,2,8-triol
CID 88722169
tricosane-1,2-diol
CID 42607324
6-(diethylamino)hexane-1,2-diol
CID 18995566
7-methyloctane-1,2,6-triol
CID 135298885
CID 158891282
CID 158891282

Frequently Asked Questions

What is the IUPAC name of 5-[hydroxy(dimethyl)silyl]pentane-1,2-diol?
The IUPAC name of 5-[hydroxy(dimethyl)silyl]pentane-1,2-diol (CID 45118377) is 5-[hydroxy(dimethyl)silyl]pentane-1,2-diol.
What is the SMILES notation for 5-[hydroxy(dimethyl)silyl]pentane-1,2-diol?
The canonical SMILES for 5-[hydroxy(dimethyl)silyl]pentane-1,2-diol is C[Si](C)(O)CCCC(O)CO.
What is the InChIKey of 5-[hydroxy(dimethyl)silyl]pentane-1,2-diol?
The InChIKey is BWEVTSLYSDAXMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18O3Si/c1-11(2,10)5-3-4-7(9)6-8/h7-10H,3-6H2,1-2H3.
What are the key properties of 5-[hydroxy(dimethyl)silyl]pentane-1,2-diol?
5-[hydroxy(dimethyl)silyl]pentane-1,2-diol has a molecular weight of 178.30 g/mol, XLogP of 0.32, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[hydroxy(dimethyl)silyl]pentane-1,2-diol is sourced from PubChem (CID 45118377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).