(phenoxydisulfanyl)oxybenzene

C12H10O2S2 — CID 25268412

IUPAC(phenoxydisulfanyl)oxybenzene
SMILESc1ccc(OSSOc2ccccc2)cc1
InChIInChI=1S/C12H10O2S2/c1-3-7-11(8-4-1)13-15-16-14-12-9-5-2-6-10-12/h1-10H
InChIKeyFXIPKYIPAFDKIL-UHFFFAOYSA-N
MW250.34 g/mol
LogP4.36
Rot. Bonds5

About (phenoxydisulfanyl)oxybenzene

(phenoxydisulfanyl)oxybenzene (PubChem CID 25268412) has the molecular formula C12H10O2S2 and a molecular weight of 250.34 g/mol. Its IUPAC name is (phenoxydisulfanyl)oxybenzene.

Molecular Properties

Compound Name(phenoxydisulfanyl)oxybenzene
PubChem CID25268412
Molecular FormulaC12H10O2S2
Molecular Weight250.34 g/mol
Exact Mass250.01
IUPAC Name(phenoxydisulfanyl)oxybenzene
SMILESc1ccc(OSSOc2ccccc2)cc1
InChIInChI=1S/C12H10O2S2/c1-3-7-11(8-4-1)13-15-16-14-12-9-5-2-6-10-12/h1-10H
InChIKeyFXIPKYIPAFDKIL-UHFFFAOYSA-N
XLogP4.36
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'sulfur_oxygen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Triphenyl phosphite
CID 7540
Phenolate Sodium
CID 4445035
Phenol sulfate
CID 74426
O,O,O-Triphenyl phosphorothioate
CID 69011
Diphenyl chlorophosphate
CID 75654
Phosphoric acid, diphenyl ester
CID 13282
Diphenyl methylphosphonate
CID 82027
Diphenyl phosphite
CID 62550
Methyl diphenyl phosphate
CID 8291
Hydron phenoxide
CID 20488062
Triphenyl borate
CID 14182
Dietholate
CID 36106

Frequently Asked Questions

What is the IUPAC name of (phenoxydisulfanyl)oxybenzene?
The IUPAC name of (phenoxydisulfanyl)oxybenzene (CID 25268412) is (phenoxydisulfanyl)oxybenzene.
What is the SMILES notation for (phenoxydisulfanyl)oxybenzene?
The canonical SMILES for (phenoxydisulfanyl)oxybenzene is c1ccc(OSSOc2ccccc2)cc1.
What is the InChIKey of (phenoxydisulfanyl)oxybenzene?
The InChIKey is FXIPKYIPAFDKIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O2S2/c1-3-7-11(8-4-1)13-15-16-14-12-9-5-2-6-10-12/h1-10H.
What are the key properties of (phenoxydisulfanyl)oxybenzene?
(phenoxydisulfanyl)oxybenzene has a molecular weight of 250.34 g/mol, XLogP of 4.36, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (phenoxydisulfanyl)oxybenzene is sourced from PubChem (CID 25268412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).