cyclopentyl phenyl sulfite

C11H14O3S — CID 150136179

IUPACcyclopentyl phenyl sulfite
SMILESO=S(Oc1ccccc1)OC1CCCC1
InChIInChI=1S/C11H14O3S/c12-15(14-11-8-4-5-9-11)13-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2
InChIKeyFCHFULGDBLUGAG-UHFFFAOYSA-N
MW226.30 g/mol
LogP2.60
Rot. Bonds4

About cyclopentyl phenyl sulfite

cyclopentyl phenyl sulfite (PubChem CID 150136179) has the molecular formula C11H14O3S and a molecular weight of 226.30 g/mol. Its IUPAC name is cyclopentyl phenyl sulfite.

Molecular Properties

Compound Namecyclopentyl phenyl sulfite
PubChem CID150136179
Molecular FormulaC11H14O3S
Molecular Weight226.30 g/mol
Exact Mass226.07
IUPAC Namecyclopentyl phenyl sulfite
SMILESO=S(Oc1ccccc1)OC1CCCC1
InChIInChI=1S/C11H14O3S/c12-15(14-11-8-4-5-9-11)13-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2
InChIKeyFCHFULGDBLUGAG-UHFFFAOYSA-N
XLogP2.60
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

dicyclohexyl sulfite
CID 557841
magnesium;cyclohexyloxybenzene;hydride
CID 174438663
ethenyl phenyl sulfite
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phenyl sulfite
CID 14972829
1-cyclohexyloxy-4-phenoxybenzene
CID 70600234
potassium phenyl sulfite
CID 162337240
sodium phenyl sulfite
CID 68748465
cyclohexyl (Z)-2-chloro-2-phenyl-1-trimethylsilylethenesulfinate
CID 10784522
phenyl (1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl) sulfite
CID 87155904
chloro-dicyclohexyloxy-phenoxysilane
CID 69485487
cyclohexyloxysulfinyl cyclohexanesulfinate
CID 22974433
cyclohexyl benzenecarboperoxoate
CID 154097275

Frequently Asked Questions

What is the IUPAC name of cyclopentyl phenyl sulfite?
The IUPAC name of cyclopentyl phenyl sulfite (CID 150136179) is cyclopentyl phenyl sulfite.
What is the SMILES notation for cyclopentyl phenyl sulfite?
The canonical SMILES for cyclopentyl phenyl sulfite is O=S(Oc1ccccc1)OC1CCCC1.
What is the InChIKey of cyclopentyl phenyl sulfite?
The InChIKey is FCHFULGDBLUGAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3S/c12-15(14-11-8-4-5-9-11)13-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2.
What are the key properties of cyclopentyl phenyl sulfite?
cyclopentyl phenyl sulfite has a molecular weight of 226.30 g/mol, XLogP of 2.60, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl phenyl sulfite is sourced from PubChem (CID 150136179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).