2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol

C8H18OS — CID 54044607

IUPAC2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol
SMILESCC(C)C(C)(C)SCCO
InChIInChI=1S/C8H18OS/c1-7(2)8(3,4)10-6-5-9/h7,9H,5-6H2,1-4H3
InChIKeyYAAZCLCJGKVXSF-UHFFFAOYSA-N
MW162.30 g/mol
LogP2.15
Rot. Bonds4

About 2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol

2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol (PubChem CID 54044607) has the molecular formula C8H18OS and a molecular weight of 162.30 g/mol. Its IUPAC name is 2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol.

Molecular Properties

Compound Name2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol
PubChem CID54044607
Molecular FormulaC8H18OS
Molecular Weight162.30 g/mol
Exact Mass162.11
IUPAC Name2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol
SMILESCC(C)C(C)(C)SCCO
InChIInChI=1S/C8H18OS/c1-7(2)8(3,4)10-6-5-9/h7,9H,5-6H2,1-4H3
InChIKeyYAAZCLCJGKVXSF-UHFFFAOYSA-N
XLogP2.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.30
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-hydroxyethylsulfanyl)-2,4-dimethylpentanoic acid
CID 114989364
ethyl N-[2-(2,3-dimethylbutan-2-ylsulfanyl)ethyl]carbamate
CID 20712463
1-[2-hydroxy-2-(2-hydroxyethylsulfanyl)propyl]sulfanyl-3-sulfanylbutan-2-ol
CID 91226498
(2R)-2-amino-3-(3-hydroxypropylsulfanyl)-3-methylbutanoic acid
CID 106442193
2-(tert-butyldisulfanyl)ethanol
CID 14965536
2-methyl-2-propan-2-ylbutane-1,4-diol
CID 54159486
2-[1-(2-hydroxyethylsulfanyl)-2-methylpropyl]sulfanylethanol
CID 154121869
(2S)-2-amino-3-(6-hydroxyhexylsulfanyl)-3-methylbutanoic acid
CID 106443145
2-[bis(2-amino-3-methylbutan-2-yl)amino]ethanol
CID 87764605
2-(5-ethyl-3-methyl-5-methylsulfanylheptan-3-yl)sulfanylethanol
CID 122536285
2,2-dimethylpropane;2-methylpropan-1-ol
CID 158369394
4-(3-hydroxypropylsulfanyl)-2,4-dimethyl-2-propan-2-ylpentane-1-sulfonic acid
CID 89358677

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol?
The IUPAC name of 2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol (CID 54044607) is 2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol.
What is the SMILES notation for 2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol?
The canonical SMILES for 2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol is CC(C)C(C)(C)SCCO.
What is the InChIKey of 2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol?
The InChIKey is YAAZCLCJGKVXSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18OS/c1-7(2)8(3,4)10-6-5-9/h7,9H,5-6H2,1-4H3.
What are the key properties of 2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol?
2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol has a molecular weight of 162.30 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylbutan-2-ylsulfanyl)ethanol is sourced from PubChem (CID 54044607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).