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Basic information
- Standard SMILES
COc1cc2c(cc1C(=O)O)OCCO2- InChIKey
WZJGVPWIHHYBEG-UHFFFAOYSA-N- Molecular formula
- C10H10O5
- Average molar mass
- 210.18 g/mol
- Monoisotopic mass
- 210.05282342
Names & identifiers
- Preferred name
- 7-Methoxy-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylic acid
- IUPAC
- 6-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxylic acid
Names & synonyms
1119833-01-07-methoxy-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylic acid7-Methoxy-2,3-dihydro-1,4-benzodioxine-6-carboxylic acidMFCD137049896-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxylic acidSCHEMBL1278933WZJGVPWIHHYBEG-UHFFFAOYSA-N7-methoxy-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylicacidSY308721
Database identifiers
- PubChem CID
- 57422331
Properties
Computed structural propertiesFilling in
- XLogP
- 1.1
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 242
Related reactions
11 records
Compound notes
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