zinc methylsulfanylethane

C6H14S2Zn — CID 154630711

IUPACzinc methylsulfanylethane
SMILES[CH2-]CSC.[CH2-]CSC.[Zn+2]
InChIInChI=1S/2C3H7S.Zn/c2*1-3-4-2;/h2*1,3H2,2H3;/q2*-1;+2
InChIKeyPFGIEYIPUKBGLK-UHFFFAOYSA-N
MW215.70 g/mol
LogP2.36
Rot. Bonds2

About zinc methylsulfanylethane

zinc methylsulfanylethane (PubChem CID 154630711) has the molecular formula C6H14S2Zn and a molecular weight of 215.70 g/mol. Its IUPAC name is zinc methylsulfanylethane.

Molecular Properties

Compound Namezinc methylsulfanylethane
PubChem CID154630711
Molecular FormulaC6H14S2Zn
Molecular Weight215.70 g/mol
Exact Mass213.98
IUPAC Namezinc methylsulfanylethane
SMILES[CH2-]CSC.[CH2-]CSC.[Zn+2]
InChIInChI=1S/2C3H7S.Zn/c2*1-3-4-2;/h2*1,3H2,2H3;/q2*-1;+2
InChIKeyPFGIEYIPUKBGLK-UHFFFAOYSA-N
XLogP2.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.70
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

chloro(methylsulfanyl)methane
CID 16916
ethylsulfanylethane;2-methylpropane;yttrium(3+)
CID 153435739
3-methylpentane;yttrium
CID 59046593
zinc;butane;hydrobromide
CID 172807669
sodium methanidylsulfanylmethane
CID 154365959
silver propane
CID 18629779
N,N-dimethylmethanamine;methylsulfanylethane
CID 145190695
trimethyl(methylsulfanylmethyl)stannane
CID 21409464
methylsulfanylethane;sulfur trioxide
CID 159085380
methyl(methylsulfanylmethyl)silane
CID 101289891
CID 58608466
CID 58608466
propane;zirconium(4+);trihydroxide
CID 165042309

Frequently Asked Questions

What is the IUPAC name of zinc methylsulfanylethane?
The IUPAC name of zinc methylsulfanylethane (CID 154630711) is zinc methylsulfanylethane.
What is the SMILES notation for zinc methylsulfanylethane?
The canonical SMILES for zinc methylsulfanylethane is [CH2-]CSC.[CH2-]CSC.[Zn+2].
What is the InChIKey of zinc methylsulfanylethane?
The InChIKey is PFGIEYIPUKBGLK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7S.Zn/c2*1-3-4-2;/h2*1,3H2,2H3;/q2*-1;+2.
What are the key properties of zinc methylsulfanylethane?
zinc methylsulfanylethane has a molecular weight of 215.70 g/mol, XLogP of 2.36, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for zinc methylsulfanylethane is sourced from PubChem (CID 154630711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).