butan-2-yl(triethyl)-λ4-sulfane

C10H24S — CID 154937143

IUPACbutan-2-yl(triethyl)-λ4-sulfane
SMILESCCC(C)S(CC)(CC)CC
InChIInChI=1S/C10H24S/c1-6-10(5)11(7-2,8-3)9-4/h10H,6-9H2,1-5H3
InChIKeyJWNLLWWIKPOUEK-UHFFFAOYSA-N
MW176.37 g/mol
LogP3.65
Rot. Bonds5

About butan-2-yl(triethyl)-λ4-sulfane

butan-2-yl(triethyl)-λ4-sulfane (PubChem CID 154937143) has the molecular formula C10H24S and a molecular weight of 176.37 g/mol. Its IUPAC name is butan-2-yl(triethyl)-λ4-sulfane.

Molecular Properties

Compound Namebutan-2-yl(triethyl)-λ4-sulfane
PubChem CID154937143
Molecular FormulaC10H24S
Molecular Weight176.37 g/mol
Exact Mass176.16
IUPAC Namebutan-2-yl(triethyl)-λ4-sulfane
SMILESCCC(C)S(CC)(CC)CC
InChIInChI=1S/C10H24S/c1-6-10(5)11(7-2,8-3)9-4/h10H,6-9H2,1-5H3
InChIKeyJWNLLWWIKPOUEK-UHFFFAOYSA-N
XLogP3.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.37
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(2R)-butane-2-sulfonic acid
CID 46398806
[(2R)-butan-2-yl]-imino-methyl-oxo-λ6-sulfane
CID 125456687
CID 87069248
CID 87069248
sulfino butane-2-sulfonate
CID 91164516
bis(butan-2-ylsulfonyloxy)bismuthanyl butane-2-sulfonate
CID 139949440
4-butan-2-ylsulfonylheptane
CID 140508909
2-[(2R)-butan-2-yl]sulfonylacetic acid
CID 28744627
sulfo butane-2-sulfonate
CID 175236017
1-butan-2-ylsulfonylpentane
CID 159645630
2-but-3-en-2-ylsulfonylbutane
CID 12672765
N-propylbutane-2-sulfonamide
CID 57021990
sulfuric acid;triethyl(methyl)phosphanium
CID 174902291

Frequently Asked Questions

What is the IUPAC name of butan-2-yl(triethyl)-λ4-sulfane?
The IUPAC name of butan-2-yl(triethyl)-λ4-sulfane (CID 154937143) is butan-2-yl(triethyl)-λ4-sulfane.
What is the SMILES notation for butan-2-yl(triethyl)-λ4-sulfane?
The canonical SMILES for butan-2-yl(triethyl)-λ4-sulfane is CCC(C)S(CC)(CC)CC.
What is the InChIKey of butan-2-yl(triethyl)-λ4-sulfane?
The InChIKey is JWNLLWWIKPOUEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24S/c1-6-10(5)11(7-2,8-3)9-4/h10H,6-9H2,1-5H3.
What are the key properties of butan-2-yl(triethyl)-λ4-sulfane?
butan-2-yl(triethyl)-λ4-sulfane has a molecular weight of 176.37 g/mol, XLogP of 3.65, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-yl(triethyl)-λ4-sulfane is sourced from PubChem (CID 154937143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).