1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol

C9H22O2Si — CID 13175134

IUPAC1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol
SMILESCC(O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C9H22O2Si/c1-8(10)7-11-12(5,6)9(2,3)4/h8,10H,7H2,1-6H3
InChIKeyBJDDRAYUVSVPPR-UHFFFAOYSA-N
MW190.36 g/mol
LogP2.39
Rot. Bonds3

About 1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol

1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol (PubChem CID 13175134) has the molecular formula C9H22O2Si and a molecular weight of 190.36 g/mol. Its IUPAC name is 1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol.

Molecular Properties

Compound Name1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol
PubChem CID13175134
Molecular FormulaC9H22O2Si
Molecular Weight190.36 g/mol
Exact Mass190.14
IUPAC Name1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol
SMILESCC(O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C9H22O2Si/c1-8(10)7-11-12(5,6)9(2,3)4/h8,10H,7H2,1-6H3
InChIKeyBJDDRAYUVSVPPR-UHFFFAOYSA-N
XLogP2.39
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.36
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol
CID 14336173
(2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol
CID 11486689
(2S)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-ol
CID 86606837
[2-bromo-3-[tert-butyl(dimethyl)silyl]oxypropoxy]-tert-butyl-dimethylsilane
CID 125380572
3-[[tert-butyl(dimethyl)silyl]oxymethyl]hexane-1,5-diol
CID 174174824
tert-butyl-[(2S)-2-fluoropropoxy]-dimethylsilane
CID 141238974
1-[tert-butyl(dimethyl)silyl]oxypentan-2-ol
CID 10608878
tert-butyl-dimethyl-[(2S)-2-methylbutoxy]silane
CID 133082116
5-[tert-butyl(dimethyl)silyl]oxy-2,4-dimethylpent-1-en-3-ol
CID 13198877
(3R)-4-[tert-butyl(dimethyl)silyl]oxy-3-hydroxybutan-2-one
CID 11672982
(2R)-3-[tert-butyl(dimethyl)silyl]oxy-2-hydroxypropanenitrile
CID 101034537
(2S)-1-[tert-butyl(dimethyl)silyl]oxybut-3-yn-2-ol
CID 20848710

Frequently Asked Questions

What is the IUPAC name of 1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol?
The IUPAC name of 1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol (CID 13175134) is 1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol.
What is the SMILES notation for 1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol?
The canonical SMILES for 1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol is CC(O)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol?
The InChIKey is BJDDRAYUVSVPPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22O2Si/c1-8(10)7-11-12(5,6)9(2,3)4/h8,10H,7H2,1-6H3.
What are the key properties of 1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol?
1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol has a molecular weight of 190.36 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol is sourced from PubChem (CID 13175134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).