diethyl-methyl-propyl-λ4-sulfane

C8H20S — CID 87264764

IUPACdiethyl-methyl-propyl-λ4-sulfane
SMILESCCCS(C)(CC)CC
InChIInChI=1S/C8H20S/c1-5-8-9(4,6-2)7-3/h5-8H2,1-4H3
InChIKeyFEBVEQKYAVNHNG-UHFFFAOYSA-N
MW148.31 g/mol
LogP2.87
Rot. Bonds4

About diethyl-methyl-propyl-λ4-sulfane

diethyl-methyl-propyl-λ4-sulfane (PubChem CID 87264764) has the molecular formula C8H20S and a molecular weight of 148.31 g/mol. Its IUPAC name is diethyl-methyl-propyl-λ4-sulfane.

Molecular Properties

Compound Namediethyl-methyl-propyl-λ4-sulfane
PubChem CID87264764
Molecular FormulaC8H20S
Molecular Weight148.31 g/mol
Exact Mass148.13
IUPAC Namediethyl-methyl-propyl-λ4-sulfane
SMILESCCCS(C)(CC)CC
InChIInChI=1S/C8H20S/c1-5-8-9(4,6-2)7-3/h5-8H2,1-4H3
InChIKeyFEBVEQKYAVNHNG-UHFFFAOYSA-N
XLogP2.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.31
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-(2-propylsulfonylethenylsulfonyl)propane
CID 14212
1-propylsulfonylpropane
CID 11709
methanesulfonic acid;propane-1-sulfonic acid
CID 87924907
dihydroxy-methyl-propyl-λ4-sulfane
CID 144593661
lithium propane-1-sulfonate
CID 131984534
bromo-diethyl-propyl-λ4-sulfane
CID 141102583
trihexyl(methyl)-λ4-sulfane
CID 138739733
1-(1-chloroethylsulfonyl)propane
CID 23323737
cerium(3+);tris(propane-1-sulfonate)
CID 159815250
methane;propane-1-sulfonamide
CID 159650684
1-[1,2,2-tris(propylsulfonyl)ethenylsulfonyl]propane
CID 3457689
potassium propane-1-sulfonate
CID 23693600

Frequently Asked Questions

What is the IUPAC name of diethyl-methyl-propyl-λ4-sulfane?
The IUPAC name of diethyl-methyl-propyl-λ4-sulfane (CID 87264764) is diethyl-methyl-propyl-λ4-sulfane.
What is the SMILES notation for diethyl-methyl-propyl-λ4-sulfane?
The canonical SMILES for diethyl-methyl-propyl-λ4-sulfane is CCCS(C)(CC)CC.
What is the InChIKey of diethyl-methyl-propyl-λ4-sulfane?
The InChIKey is FEBVEQKYAVNHNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20S/c1-5-8-9(4,6-2)7-3/h5-8H2,1-4H3.
What are the key properties of diethyl-methyl-propyl-λ4-sulfane?
diethyl-methyl-propyl-λ4-sulfane has a molecular weight of 148.31 g/mol, XLogP of 2.87, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-methyl-propyl-λ4-sulfane is sourced from PubChem (CID 87264764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).