[(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene

C14H11ClOS — CID 139262815

IUPAC[(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene
SMILESO=S(/C=C(\Cl)c1ccccc1)c1ccccc1
InChIInChI=1S/C14H11ClOS/c15-14(12-7-3-1-4-8-12)11-17(16)13-9-5-2-6-10-13/h1-11H/b14-11-
InChIKeyJSEMLZBOCBNIAK-KAMYIIQDSA-N
MW262.76 g/mol
LogP4.03
Rot. Bonds3

About [(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene

[(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene (PubChem CID 139262815) has the molecular formula C14H11ClOS and a molecular weight of 262.76 g/mol. Its IUPAC name is [(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene.

Molecular Properties

Compound Name[(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene
PubChem CID139262815
Molecular FormulaC14H11ClOS
Molecular Weight262.76 g/mol
Exact Mass262.02
IUPAC Name[(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene
SMILESO=S(/C=C(\Cl)c1ccccc1)c1ccccc1
InChIInChI=1S/C14H11ClOS/c15-14(12-7-3-1-4-8-12)11-17(16)13-9-5-2-6-10-13/h1-11H/b14-11-
InChIKeyJSEMLZBOCBNIAK-KAMYIIQDSA-N
XLogP4.03
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.76
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[(E)-1-(benzenesulfinyl)hex-1-en-2-yl]benzene
CID 138974661
[(Z)-2-chloro-2-phenylethenyl]phosphonic acid
CID 2249320
bis(2-chloro-2-phenylethenyl)phosphinic acid
CID 71361509
(Z)-3-(benzenesulfinyl)-2-iodoprop-2-en-1-ol
CID 101088179
1-[1-(benzenesulfinyl)-3,3,3-trifluoroprop-1-en-2-yl]-3,5-dichlorobenzene
CID 131737199
benzenesulfinylformaldehyde
CID 174391009
(Z)-3-chloro-3-phenylprop-2-enoyl chloride
CID 13053218
(E)-4-(benzenesulfinyl)-3-bromo-2-methylbut-3-en-2-ol
CID 134935679
5-[(Z)-1-(benzenesulfinyl)-3,3,3-trifluoroprop-1-en-2-yl]-1,2,3-trichlorobenzene
CID 118344758
(Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol
CID 11301041
[(E)-2-chloro-2-phenylethenyl]-trifluoroboranuide
CID 102291546
(Z)-3-chloro-1,3-diphenylprop-2-en-1-one
CID 12890118

Frequently Asked Questions

What is the IUPAC name of [(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene?
The IUPAC name of [(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene (CID 139262815) is [(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene.
What is the SMILES notation for [(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene?
The canonical SMILES for [(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene is O=S(/C=C(\Cl)c1ccccc1)c1ccccc1.
What is the InChIKey of [(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene?
The InChIKey is JSEMLZBOCBNIAK-KAMYIIQDSA-N. The full InChI is InChI=1S/C14H11ClOS/c15-14(12-7-3-1-4-8-12)11-17(16)13-9-5-2-6-10-13/h1-11H/b14-11-.
What are the key properties of [(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene?
[(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene has a molecular weight of 262.76 g/mol, XLogP of 4.03, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene is sourced from PubChem (CID 139262815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).