Basic information
- Standard SMILES
COC(=O)c1c(O)cccc1C=O- InChIKey
WDYYLHVXCSRDRG-UHFFFAOYSA-N- Molecular formula
- C9H8O4
- Average molar mass
- 180.16 g/mol
Names & identifiers
- Preferred name
- Methyl 2-formyl-6-hydroxybenzoate
- IUPAC
- methyl 2-formyl-6-hydroxybenzoate
Names & synonyms
methyl 2-formyl-6-hydroxybenzoate136192-84-2methyl2-formyl-6-hydroxybenzoateNSC404003SCHEMBL7836382WDYYLHVXCSRDRG-UHFFFAOYSA-Nmethyl 2-formyl-6-hydroxy-benzoateNSC-404003CS-0140946EN300-1081950
Database identifiers
- PubChem CID
- 346008
- Nikkaji
- J883.418K
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 202
Related reactions
3 records
Compound notes
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