Basic information
- CAS
920489-98-1- Standard SMILES
C=Cc1cc(O)cc(OC(C)=O)c1- InChIKey
MKGQHSMFHGYADS-UHFFFAOYSA-N- Molecular formula
- C10H10O3
- Average molar mass
- 178.18 g/mol
- Monoisotopic mass
- 178.06299418
Names & identifiers
- Preferred name
- 3-Ethenyl-5-hydroxyphenyl acetate
- IUPAC
- (3-ethenyl-5-hydroxyphenyl) acetate
- English name
- 3-Acetoxy-5-hydroxy Styrene
- Molecular formula
- C10H10O3
- Molecular weight
- 178.18
Names & synonyms
920489-98-13-ethenyl-5-hydroxyphenyl acetateDTXSID30700728RefChem:278961DTXCID606514763-ACETOXY-5-HYDROXY STYRENE(3-ethenyl-5-hydroxyphenyl) acetate3-hydroxy-5-vinylphenyl acetate5-Ethenyl-1,3-benzenediol 1-Acetate; 5-Acetoxy-3-hydroxy StyreneSCHEMBL28454891DB-315060G61667
Show more names
5-Acetoxy-3-hydroxy Styrene5-Ethenyl-1,3-benzenediol 1-Acetate1,3-Benzenediol, 5-ethenyl-, 1-acetate
Database identifiers
- CAS
920489-98-1- PubChem CID
- 53434945
- DTXSID
DTXSID30700728
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 200
Physicochemical properties
- Boiling point
- 336.4 · 336.4±42.0 °C(Predicted)
- Density
- 1.176 · 1.176±0.06 g/cm3(Predicted)
- solubility
- Dichloromethane, Methanol
- pka
- 9.03 · 9.03±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
UsesIntermediate for the synthesis of Resveratrol
Suppliers5 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
上海有集材料有限公司13052376889 13681663468 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…