Basic information
- CAS
1134641-64-7- Standard SMILES
C=CCc1cc(OC)c2c(c1)OCO2.Cl- InChIKey
CWBOPBUVZGZVIG-UHFFFAOYSA-N- Molecular formula
- C11H13ClO3
- Average molar mass
- 228.67 g/mol
- Monoisotopic mass
- 228.055322
Names & identifiers
- Preferred name
- Ahm8PZ9gdb
- IUPAC
- 4-methoxy-6-prop-2-enyl-1,3-benzodioxole;hydrochloride
Names & synonyms
AHM8PZ9GDBSCHEMBL288103271,3-BENZODIOXOLE, 4-METHOXY-6-(2-PROPEN-1-YL)-, HYDROCHLORIDE (1:1)1134641-64-7
Database identifiers
- CAS
1134641-64-7- PubChem CID
- 175283450
- UNII
- AHM8PZ9GDB
Properties
Computed structural properties
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 205
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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