Basic information
- CAS
80592-85-4- Standard SMILES
CCN(CC)Cc1oc2ccc(Cl)cc2c1-c1ccccc1- InChIKey
MTCGLSWFDICWRN-UHFFFAOYSA-N- Molecular formula
- C19H20ClNO
- Average molar mass
- 313.8 g/mol
- Monoisotopic mass
- 313.123342
Names & identifiers
- Preferred name
- Benzofuran, 5-chloro-2-(diethylaminomethyl)-3-phenyl-
- IUPAC
- N-[(5-chloro-3-phenyl-1-benzofuran-2-yl)methyl]-N-ethylethanamine
- English name
- Benzofuran, 5-chloro-2-(diethylaminomethyl)-3-phenyl-
- Molecular formula
- C19H20ClNO
- Molecular weight
- 313.82
Names & synonyms
80592-85-4BRN 1388315BENZOFURAN, 5-CHLORO-2-(DIETHYLAMINOMETHYL)-3-PHENYL-5-Chloro-2-diethylaminomethyl-3-phenylbenzofuran2-Chloro-2-(diethylaminomethyl)-3-phenylbenzofuranDTXSID90230430RefChem:326467DTXCID90152921N-[(5-chloro-3-phenyl-1-benzofuran-2-yl)methyl]-N-ethylethanamineN-[(5-Chloro-3-phenyl-1-benzo[b]furan-2-yl)methyl]-N-ethylethanamine2-Benzofuranmethanamine, 5-chloro-N,N-diethyl-3-phenyl-
Database identifiers
- CAS
80592-85-4- PubChem CID
- 54588
- DTXSID
DTXSID90230430- Nikkaji
- J71.516F
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 16.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 340
Physicochemical properties
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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