2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene

C7H7ClOS2 — CID 124725146

IUPAC2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene
SMILESC[S@](=O)/C(Cl)=C/c1cccs1
InChIInChI=1S/C7H7ClOS2/c1-11(9)7(8)5-6-3-2-4-10-6/h2-5H,1H3/b7-5+/t11-/m0/s1
InChIKeyXDCGAOUMMVCFIZ-ZRQQLDRUSA-N
MW206.72 g/mol
LogP2.66
Rot. Bonds2

About 2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene

2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene (PubChem CID 124725146) has the molecular formula C7H7ClOS2 and a molecular weight of 206.72 g/mol. Its IUPAC name is 2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene.

Molecular Properties

Compound Name2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene
PubChem CID124725146
Molecular FormulaC7H7ClOS2
Molecular Weight206.72 g/mol
Exact Mass205.96
IUPAC Name2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene
SMILESC[S@](=O)/C(Cl)=C/c1cccs1
InChIInChI=1S/C7H7ClOS2/c1-11(9)7(8)5-6-3-2-4-10-6/h2-5H,1H3/b7-5+/t11-/m0/s1
InChIKeyXDCGAOUMMVCFIZ-ZRQQLDRUSA-N
XLogP2.66
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.72
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(E)-2-chloro-2-(4-methylphenyl)sulfinylethenyl]thiophene
CID 102532992
2-[(Z)-2-chloro-2-[(S)-(4-methylphenyl)sulfinyl]ethenyl]thiophene
CID 11033348
(E)-2-chloro-3-thiophen-2-ylprop-2-enoic acid
CID 88503797
methyl (Z)-2-hydroxy-3-thiophen-2-ylprop-2-enoate
CID 52985524
2-(thiophen-2-ylmethylidene)propanedioic acid
CID 4714957
(E)-2-cyano-3-thiophen-2-ylprop-2-enoyl chloride
CID 15335281
2-(thiophen-2-ylmethylidene)butanal
CID 79001686
(E)-N,N,2-trimethyl-3-thiophen-2-ylprop-2-enamide
CID 14383806
2-(thiophen-2-ylmethylidene)propanediamide
CID 5079332
(Z)-2-chloro-1-(5-methylfuran-2-yl)-3-thiophen-2-ylprop-2-en-1-one
CID 16657925
methyl 2-methyl-3-thiophen-2-ylprop-2-enoate
CID 57285992
(2E)-3-methyl-2-(thiophen-2-ylmethylidene)but-3-enal
CID 10749828

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene?
The IUPAC name of 2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene (CID 124725146) is 2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene.
What is the SMILES notation for 2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene?
The canonical SMILES for 2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene is C[S@](=O)/C(Cl)=C/c1cccs1.
What is the InChIKey of 2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene?
The InChIKey is XDCGAOUMMVCFIZ-ZRQQLDRUSA-N. The full InChI is InChI=1S/C7H7ClOS2/c1-11(9)7(8)5-6-3-2-4-10-6/h2-5H,1H3/b7-5+/t11-/m0/s1.
What are the key properties of 2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene?
2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene has a molecular weight of 206.72 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2-chloro-2-[(S)-methylsulfinyl]ethenyl]thiophene is sourced from PubChem (CID 124725146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).