(E)-2-(4-chlorophenyl)ethenesulfinyl chloride

C8H6Cl2OS — CID 22721884

IUPAC(E)-2-(4-chlorophenyl)ethenesulfinyl chloride
SMILESO=S(Cl)/C=C/c1ccc(Cl)cc1
InChIInChI=1S/C8H6Cl2OS/c9-8-3-1-7(2-4-8)5-6-12(10)11/h1-6H/b6-5+
InChIKeyLKPTXHKOKIAZMH-AATRIKPKSA-N
MW221.11 g/mol
LogP3.21
Rot. Bonds2

About (E)-2-(4-chlorophenyl)ethenesulfinyl chloride

(E)-2-(4-chlorophenyl)ethenesulfinyl chloride (PubChem CID 22721884) has the molecular formula C8H6Cl2OS and a molecular weight of 221.11 g/mol. Its IUPAC name is (E)-2-(4-chlorophenyl)ethenesulfinyl chloride.

Molecular Properties

Compound Name(E)-2-(4-chlorophenyl)ethenesulfinyl chloride
PubChem CID22721884
Molecular FormulaC8H6Cl2OS
Molecular Weight221.11 g/mol
Exact Mass219.95
IUPAC Name(E)-2-(4-chlorophenyl)ethenesulfinyl chloride
SMILESO=S(Cl)/C=C/c1ccc(Cl)cc1
InChIInChI=1S/C8H6Cl2OS/c9-8-3-1-7(2-4-8)5-6-12(10)11/h1-6H/b6-5+
InChIKeyLKPTXHKOKIAZMH-AATRIKPKSA-N
XLogP3.21
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.11
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(E)-2-tert-butylsulfinylethenyl]-4-chlorobenzene
CID 132520428
1-[2-(benzenesulfinyl)ethenyl]-4-chlorobenzene
CID 819546
2-(4-chlorophenyl)-N-phenylethenesulfinamide
CID 3716001
(E)-4-(4-chlorophenyl)-1-[2-(4-chlorophenyl)ethenylsulfinyl]but-3-en-2-one
CID 66992774
1-chloro-4-[[(E)-2-(4-fluorophenyl)ethenyl]sulfinylmethyl]benzene
CID 66810700
4-(4-chlorophenyl)-1-[2-(4-chlorophenyl)ethenylsulfinyl]-1-iodobut-3-en-2-one
CID 173174303
(E)-4-(4-chlorophenyl)-4-[2-(4-chlorophenyl)ethenylsulfinyl]but-3-en-2-one
CID 69483889
1-[(E)-2-bromoethenyl]-4-chlorobenzene
CID 5372382
4-chlorobenzaldehyde
CID 7726
(E)-3-(4-chlorophenyl)prop-2-enoyl chloride
CID 11252649
4-[(E)-2-(4-chlorophenyl)ethenyl]phenol
CID 5376643
1-chloro-4-[6-(4-chlorophenyl)hexa-1,5-dienyl]benzene
CID 141391243

Frequently Asked Questions

What is the IUPAC name of (E)-2-(4-chlorophenyl)ethenesulfinyl chloride?
The IUPAC name of (E)-2-(4-chlorophenyl)ethenesulfinyl chloride (CID 22721884) is (E)-2-(4-chlorophenyl)ethenesulfinyl chloride.
What is the SMILES notation for (E)-2-(4-chlorophenyl)ethenesulfinyl chloride?
The canonical SMILES for (E)-2-(4-chlorophenyl)ethenesulfinyl chloride is O=S(Cl)/C=C/c1ccc(Cl)cc1.
What is the InChIKey of (E)-2-(4-chlorophenyl)ethenesulfinyl chloride?
The InChIKey is LKPTXHKOKIAZMH-AATRIKPKSA-N. The full InChI is InChI=1S/C8H6Cl2OS/c9-8-3-1-7(2-4-8)5-6-12(10)11/h1-6H/b6-5+.
What are the key properties of (E)-2-(4-chlorophenyl)ethenesulfinyl chloride?
(E)-2-(4-chlorophenyl)ethenesulfinyl chloride has a molecular weight of 221.11 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-(4-chlorophenyl)ethenesulfinyl chloride is sourced from PubChem (CID 22721884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).