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Basic information
- Standard SMILES
CCNCC1Cc2c(Cl)c(Cl)cc(Cl)c2O1- InChIKey
JAWVDRIAMQWDTA-UHFFFAOYSA-N- Molecular formula
- C11H12Cl3NO
- Average molar mass
- 280.6 g/mol
- Monoisotopic mass
- 278.998447
Names & identifiers
- Preferred name
- N-[(4,5,7-trichloro-2,3-dihydro-1-benzofuran-2-yl)methyl]ethanamine
- IUPAC
- N-[(4,5,7-trichloro-2,3-dihydro-1-benzofuran-2-yl)methyl]ethanamine
Database identifiers
- PubChem CID
- 36773
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
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Compound notes
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