diphenyl sulfite

C12H10O3S — CID 11390667

IUPACdiphenyl sulfite
SMILESO=S(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/C12H10O3S/c13-16(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H
InChIKeyAVGYVDOSBJFXFR-UHFFFAOYSA-N
MW234.28 g/mol
LogP2.72
Rot. Bonds4

About diphenyl sulfite

diphenyl sulfite (PubChem CID 11390667) has the molecular formula C12H10O3S and a molecular weight of 234.28 g/mol. Its IUPAC name is diphenyl sulfite.

Molecular Properties

Compound Namediphenyl sulfite
PubChem CID11390667
Molecular FormulaC12H10O3S
Molecular Weight234.28 g/mol
Exact Mass234.04
IUPAC Namediphenyl sulfite
SMILESO=S(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/C12H10O3S/c13-16(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H
InChIKeyAVGYVDOSBJFXFR-UHFFFAOYSA-N
XLogP2.72
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of diphenyl sulfite?
The IUPAC name of diphenyl sulfite (CID 11390667) is diphenyl sulfite.
What is the SMILES notation for diphenyl sulfite?
The canonical SMILES for diphenyl sulfite is O=S(Oc1ccccc1)Oc1ccccc1.
What is the InChIKey of diphenyl sulfite?
The InChIKey is AVGYVDOSBJFXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O3S/c13-16(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H.
What are the key properties of diphenyl sulfite?
diphenyl sulfite has a molecular weight of 234.28 g/mol, XLogP of 2.72, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl sulfite is sourced from PubChem (CID 11390667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).