Basic information
- CAS
68595-46-0- Standard SMILES
COC(=O)c1ccc(O)c(C(=O)c2cccc(OC)c2)c1- InChIKey
WVHCMUKWRQHCPT-UHFFFAOYSA-N- Molecular formula
- C16H14O5
- Average molar mass
- 286.28 g/mol
- Monoisotopic mass
- 286.08412354
Names & identifiers
- Preferred name
- Methyl 4-hydroxy-3-(3-methoxybenzoyl)benzoate
- IUPAC
- methyl 4-hydroxy-3-(3-methoxybenzoyl)benzoate
- English name
- 4-Hydroxy-3-(3-methoxybenzoyl)benzoic acid methyl ester
- Molecular formula
- C16H14O5
- Molecular weight
- 286.28
Names & synonyms
68595-46-0methyl 4-hydroxy-3-(3-methoxybenzoyl)benzoateDTXSID20497796RefChem:355735DTXCID604486064-Hydroxy-3-(3-methoxybenzoyl)benzoic acid methyl esterWVHCMUKWRQHCPT-UHFFFAOYSA-NBenzoic acid, 4-hydroxy-3-(3-methoxybenzoyl)-, methyl ester
Database identifiers
- CAS
68595-46-0- PubChem CID
- 12427751
- DTXSID
DTXSID20497796- Nikkaji
- J145.508G
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 381
Chemistry & industry
Applications
Uses4-Hydroxy-3-(3-methoxybenzoyl)benzoic Acid Methyl Ester is used in the synthetic preparation of 9-oxoxanthen-2-carboxylic acids.
Suppliers3 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [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…