1-(benzenesulfinyl)ethenylsulfinylbenzene

C14H12O2S2 — CID 19348887

IUPAC1-(benzenesulfinyl)ethenylsulfinylbenzene
SMILESC=C(S(=O)c1ccccc1)S(=O)c1ccccc1
InChIInChI=1S/C14H12O2S2/c1-12(17(15)13-8-4-2-5-9-13)18(16)14-10-6-3-7-11-14/h2-11H,1H2
InChIKeyDYJBNTDHQAEEFG-UHFFFAOYSA-N
MW276.38 g/mol
LogP3.07
Rot. Bonds4

About 1-(benzenesulfinyl)ethenylsulfinylbenzene

1-(benzenesulfinyl)ethenylsulfinylbenzene (PubChem CID 19348887) has the molecular formula C14H12O2S2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-(benzenesulfinyl)ethenylsulfinylbenzene.

Molecular Properties

Compound Name1-(benzenesulfinyl)ethenylsulfinylbenzene
PubChem CID19348887
Molecular FormulaC14H12O2S2
Molecular Weight276.38 g/mol
Exact Mass276.03
IUPAC Name1-(benzenesulfinyl)ethenylsulfinylbenzene
SMILESC=C(S(=O)c1ccccc1)S(=O)c1ccccc1
InChIInChI=1S/C14H12O2S2/c1-12(17(15)13-8-4-2-5-9-13)18(16)14-10-6-3-7-11-14/h2-11H,1H2
InChIKeyDYJBNTDHQAEEFG-UHFFFAOYSA-N
XLogP3.07
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(benzenesulfinyl)ethenylsulfinylbenzene?
The IUPAC name of 1-(benzenesulfinyl)ethenylsulfinylbenzene (CID 19348887) is 1-(benzenesulfinyl)ethenylsulfinylbenzene.
What is the SMILES notation for 1-(benzenesulfinyl)ethenylsulfinylbenzene?
The canonical SMILES for 1-(benzenesulfinyl)ethenylsulfinylbenzene is C=C(S(=O)c1ccccc1)S(=O)c1ccccc1.
What is the InChIKey of 1-(benzenesulfinyl)ethenylsulfinylbenzene?
The InChIKey is DYJBNTDHQAEEFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O2S2/c1-12(17(15)13-8-4-2-5-9-13)18(16)14-10-6-3-7-11-14/h2-11H,1H2.
What are the key properties of 1-(benzenesulfinyl)ethenylsulfinylbenzene?
1-(benzenesulfinyl)ethenylsulfinylbenzene has a molecular weight of 276.38 g/mol, XLogP of 3.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzenesulfinyl)ethenylsulfinylbenzene is sourced from PubChem (CID 19348887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).