Sulfurous acid, bis(2-phenylethyl) ester
Basic information
- CAS
24281-43-4- Standard SMILES
O=S(OCCc1ccccc1)OCCc1ccccc1- InChIKey
JXTJPLKXVAGMIW-UHFFFAOYSA-N- Molecular formula
- C16H18O3S
- Average molar mass
- 290.4 g/mol
- Monoisotopic mass
- 290.09766561
Names & identifiers
- Preferred name
- Sulfurous acid, bis(2-phenylethyl) ester
- IUPAC
- bis(2-phenylethyl) sulfite
- English name
- Sulfurous acid bis(2-phenylethyl) ester
- Molecular formula
- C16H18O3S
- Molecular weight
- 290.38
Names & synonyms
Bis(2-phenylethyl) sulfite2-Phenethyl sulfiteSulfurous acid, diphenethyl ester24281-43-4BRN 2565689Sulfurous acid, bis(2-phenylethyl) esterDTXSID70179015Sulfurous acid, bis(2-phenylethyl) ester (9CI)4-06-00-03076 (Beilstein Handbook Reference)RefChem:382716DTXCID00101506Sulfurous acid bis(2-phenylethyl) ester
Show more names
SCHEMBL8158322
Database identifiers
- CAS
24281-43-4- PubChem CID
- 212477
- DTXSID
DTXSID70179015- Nikkaji
- J48.692B
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 54.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 245
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Compound notes
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