chloro-bis(ethenyl)-methyl-λ4-sulfane

C5H9ClS — CID 163536559

IUPACchloro-bis(ethenyl)-methyl-λ4-sulfane
SMILESC=CS(C)(Cl)C=C
InChIInChI=1S/C5H9ClS/c1-4-7(3,6)5-2/h4-5H,1-2H2,3H3
InChIKeyDXMIKGBPZYEELT-UHFFFAOYSA-N
MW136.65 g/mol
LogP2.86
Rot. Bonds2

About chloro-bis(ethenyl)-methyl-λ4-sulfane

chloro-bis(ethenyl)-methyl-λ4-sulfane (PubChem CID 163536559) has the molecular formula C5H9ClS and a molecular weight of 136.65 g/mol. Its IUPAC name is chloro-bis(ethenyl)-methyl-λ4-sulfane.

Molecular Properties

Compound Namechloro-bis(ethenyl)-methyl-λ4-sulfane
PubChem CID163536559
Molecular FormulaC5H9ClS
Molecular Weight136.65 g/mol
Exact Mass136.01
IUPAC Namechloro-bis(ethenyl)-methyl-λ4-sulfane
SMILESC=CS(C)(Cl)C=C
InChIInChI=1S/C5H9ClS/c1-4-7(3,6)5-2/h4-5H,1-2H2,3H3
InChIKeyDXMIKGBPZYEELT-UHFFFAOYSA-N
XLogP2.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.65
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Ethyl Vinyl Sulfide
CID 12320
Propane, 2-ethenylthio-
CID 140443
(Z)-1,2-Dimethylthioethene
CID 5463511
Dimethylvinylsulfonium bromide
CID 19360990
(E)-Ethylene, 1,2-bis(methylthio)-
CID 5370886
1,2-Bis(ethylthio)ethene
CID 5372988
1,2-Bis(methylthio)ethene
CID 136584
1,2-Bis(ethylsulfanyl)ethene
CID 139669
Ethenyl(dimethyl)sulfanium
CID 10952891
Ethenyl(dimethyl)sulfanium iodide
CID 10987670
Dimethyl-vinyl-sulfonium iodide
CID 14942447
Bromo-ethenyl-dimethyl-lambda4-sulfane
CID 134996536

Frequently Asked Questions

What is the IUPAC name of chloro-bis(ethenyl)-methyl-λ4-sulfane?
The IUPAC name of chloro-bis(ethenyl)-methyl-λ4-sulfane (CID 163536559) is chloro-bis(ethenyl)-methyl-λ4-sulfane.
What is the SMILES notation for chloro-bis(ethenyl)-methyl-λ4-sulfane?
The canonical SMILES for chloro-bis(ethenyl)-methyl-λ4-sulfane is C=CS(C)(Cl)C=C.
What is the InChIKey of chloro-bis(ethenyl)-methyl-λ4-sulfane?
The InChIKey is DXMIKGBPZYEELT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9ClS/c1-4-7(3,6)5-2/h4-5H,1-2H2,3H3.
What are the key properties of chloro-bis(ethenyl)-methyl-λ4-sulfane?
chloro-bis(ethenyl)-methyl-λ4-sulfane has a molecular weight of 136.65 g/mol, XLogP of 2.86, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-bis(ethenyl)-methyl-λ4-sulfane is sourced from PubChem (CID 163536559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).