Basic information
- Standard SMILES
CN1CCC(Oc2c(Cl)cccc2Cl)c2ccoc2C1.Cl- InChIKey
ISCYWUAJZRGLGO-UHFFFAOYSA-N- Molecular formula
- C15H16Cl3NO2
- Average molar mass
- 348.6 g/mol
- Monoisotopic mass
- 347.024662
Names & identifiers
- Preferred name
- 4-(2,6-Dichlorophenyloxy)-7-methyl-5,6,7,8-tetrahydro-4H-furo[2,3-c]azepine hydrochloride
- IUPAC
- 4-(2,6-dichlorophenoxy)-7-methyl-4,5,6,8-tetrahydrofuro[2,3-c]azepine;hydrochloride
Names & synonyms
SCHEMBL2844001ISCYWUAJZRGLGO-UHFFFAOYSA-N4-(2,6-Dichlorophenyloxy)-7-methyl-5,6,7,8-tetrahydro-4H-furo[2,3-c]azepine hydrochloride
Database identifiers
- PubChem CID
- 68413145
Properties
Computed structural properties
- Topological polar surface area
- 25.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 321
Related reactions
1 records
Compound notes
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