Basic information
- CAS
24314-70-3- Standard SMILES
COC(=O)C(C)c1ccc2c(c1)OCO2- InChIKey
ZUFFHFHJHSEHJI-UHFFFAOYSA-N- Molecular formula
- C11H12O4
- Average molar mass
- 208.21 g/mol
- Monoisotopic mass
- 208.07355886
Names & identifiers
- Preferred name
- 2-Benzo[1,3]dioxol-5-YL-propanoic acid methyl ester
- IUPAC
- methyl 2-(1,3-benzodioxol-5-yl)propanoate
- English name
- 2-BENZO[1,3]DIOXOL-5-YL-PROPIONIC ACID METHYL ESTER
- Molecular formula
- C11H12O4
- Molecular weight
- 208.21058
Names & synonyms
24314-70-32-BENZO[1,3]DIOXOL-5-YL-PROPANOIC ACID METHYL ESTERSCHEMBL1746047DTXSID80670028ZUFFHFHJHSEHJI-UHFFFAOYSA-NAKOS015965165Methyl 2-(3,4-Methylenedioxyphenyl)propionateMETHYL 2-(2H-1,3-BENZODIOXOL-5-YL)PROPANOATE2-BENZO[1,3]DIOXOL-5-YL-PROPIONIC ACID METHYL ESTER
Database identifiers
- CAS
24314-70-3- PubChem CID
- 45358193
- DTXSID
DTXSID80670028
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 241
Chemistry & industry
Suppliers4 total
APAC Pharmaceutical, LLC[email protected]
Leancare Ltd.[email protected]
AlliChem, LLC[email protected]
CHEMPACIFIC[email protected]
Related reactions
7 records
Compound notes
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