Basic information
- Standard SMILES
O=C(O)C=Cc1ccc2c(c1)OCCO2- InChIKey
KPDOZWMLNDDCDJ-UHFFFAOYSA-N- Molecular formula
- C11H10O4
- Average molar mass
- 206.19 g/mol
- Monoisotopic mass
- 206.0579088
Names & identifiers
- Preferred name
- 3-(2,3-Dihydro-1,4-benzodioxin-6-yl)acrylic acid
- IUPAC
- 3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoic acid
Names & synonyms
3-(2,3-dihydro-1,4-benzodioxin-6-yl)acrylic acid3-(1,4-benzodioxan-6-yl)acrylic acidSCHEMBL2730205KPDOZWMLNDDCDJ-UHFFFAOYSA-NBGA53959
Database identifiers
- PubChem CID
- 4644031
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 261
Related reactions
6 records
Compound notes
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