1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol

C11H26O2Si — CID 14336173

IUPAC1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol
SMILESCC(C)C(O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O2Si/c1-9(2)10(12)8-13-14(6,7)11(3,4)5/h9-10,12H,8H2,1-7H3
InChIKeyRGAVNVRNUNINOZ-UHFFFAOYSA-N
MW218.41 g/mol
LogP3.03
Rot. Bonds4

About 1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol

1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol (PubChem CID 14336173) has the molecular formula C11H26O2Si and a molecular weight of 218.41 g/mol. Its IUPAC name is 1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol.

Molecular Properties

Compound Name1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol
PubChem CID14336173
Molecular FormulaC11H26O2Si
Molecular Weight218.41 g/mol
Exact Mass218.17
IUPAC Name1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol
SMILESCC(C)C(O)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O2Si/c1-9(2)10(12)8-13-14(6,7)11(3,4)5/h9-10,12H,8H2,1-7H3
InChIKeyRGAVNVRNUNINOZ-UHFFFAOYSA-N
XLogP3.03
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.41
LogP ≤ 53.03
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

(2R,3R,4R,5R)-1,6-bis[[tert-butyl(dimethyl)silyl]oxy]hexane-2,3,4,5-tetrol
CID 11486689
1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol
CID 13175134
(2S,3R)-4-[tert-butyl(dimethyl)silyl]oxy-2-iodobutane-1,3-diol
CID 102271148
(2S)-1-[tert-butyl(dimethyl)silyl]oxybutan-2-ol
CID 86606837
1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine
CID 53427177
(2R,3R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methylhex-5-en-3-ol
CID 11276618
tert-butyl-[(2S)-2-fluoropropoxy]-dimethylsilane
CID 141238974
(2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride
CID 50999200
1-[tert-butyl(dimethyl)silyl]oxypentan-2-ol
CID 10608878
(2S,3S)-1,4-bis[[tert-butyl(dimethyl)silyl]oxy]-3-(methoxymethoxy)butan-2-ol
CID 101252863
(2R,3S)-4-[tert-butyl(dimethyl)silyl]oxy-2-prop-1-en-2-ylbutane-1,3-diol
CID 10587455
(2R,3S)-1-[tert-butyl(dimethyl)silyl]oxy-3-methoxy-5-methylhex-5-en-2-ol
CID 58797956

Frequently Asked Questions

What is the IUPAC name of 1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol?
The IUPAC name of 1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol (CID 14336173) is 1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol.
What is the SMILES notation for 1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol?
The canonical SMILES for 1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol is CC(C)C(O)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol?
The InChIKey is RGAVNVRNUNINOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26O2Si/c1-9(2)10(12)8-13-14(6,7)11(3,4)5/h9-10,12H,8H2,1-7H3.
What are the key properties of 1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol?
1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-ol has a molecular weight of 218.41 g/mol, XLogP of 3.03, 4 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]oxy-3-methylbutan-2-ol is sourced from PubChem (CID 14336173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).