Basic information
- CAS
73663-93-1- Standard SMILES
CCOC(=O)/C=C\S(=O)c1ccccc1- InChIKey
CSHWPMGIWDFXRH-UHFFFAOYSA-N- Molecular formula
- C11H12O3S
- Average molar mass
- 224.28 g/mol
- Monoisotopic mass
- 224.05071541
Names & identifiers
- Preferred name
- Acrylic acid, 3-(phenylsulfinyl)-, ethyl ester
- IUPAC
- ethyl (Z)-3-(benzenesulfinyl)prop-2-enoate
- English name
- 3-(Phenylsulfinyl)acrylic acid ethyl ester
- Molecular formula
- C11H12O3S
- Molecular weight
- 224.28
Names & synonyms
73663-93-1ACRYLIC ACID, 3-(PHENYLSULFINYL)-, ETHYL ESTERRefChem:10761033-(Phenylsulfinyl)acrylic acid ethyl esterethyl (Z)-3-(benzenesulfinyl)prop-2-enoateEthyl 3-(phenylsulfinyl)acrylate2-Propenoic acid, 3-(phenylsulfinyl)-, ethyl ester
Database identifiers
- CAS
73663-93-1- PubChem CID
- 6435232
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 62.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 255
Physicochemical properties
- Boiling point
- 399 · 399.0±25.0 °C(Predicted)
- Density
- 1.24 · 1.24±0.1 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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