Chlorbenzoxamine
Basic information
- CAS
522-18-9- Standard SMILES
Cc1ccccc1CN1CCN(CCOC(c2ccccc2)c2ccccc2Cl)CC1- InChIKey
VEVSKUJZSMGTMM-UHFFFAOYSA-N- Molecular formula
- C27H31ClN2O
- Average molar mass
- 435 g/mol
- Monoisotopic mass
- 434.2124913
Overview
Chlorbenzoxamine is a diarylmethane.
Names & identifiers
- Preferred name
- Chlorbenzoxamine
- IUPAC
- 1-[2-[(2-chlorophenyl)-phenylmethoxy]ethyl]-4-[(2-methylphenyl)methyl]piperazine
- English name
- chlorbenzoxamine
- Molecular formula
- C27H31ClN2O
- Molecular weight
- 435
Names & synonyms
ChlorbenzoxamineClorbenzoxaminaClorbenzossamina522-18-9ChlorbenzoxaminumChlorbenzoxamine [INN]Clorbenzossamina [DCIT]UNII-N52918SLYNChlorbenzoxaminum [INN-Latin]Clorbenzoxamina [INN-Spanish]N52918SLYNChlorbenzoxamine (INN)
Show more names
ChlorobenzoxamineChlorbenzoxyethamine1-[2-[(2-Chlorophenyl)phenylmethoxy]ethyl]-4-[(2-methylphenyl)methyl]piperazinePiperazine, 1-[2-[(2-chlorophenyl)phenylmethoxy]ethyl]-4-[(2-methylphenyl)methyl]-
EINECS 208-323-0CHLORBENZOXAMINE [MI]CHLORBENZOXAMINE [WHO-DD]1-{2-[(2-chlorophenyl)(phenyl)methoxy]ethyl}-4-[(2-methylphenyl)methyl]piperazineChlorbenzoxaminum (INN-Latin)Clorbenzoxamina (INN-Spanish)1-(2-(O-CHLORO-.ALPHA.-PHENYLBENZYLOXY)ETHYL)-4-O-METHYLBENZYLPIPERAZINE1-(2-((2-chlorophenyl)(phenyl)methoxy)ethyl)-4-((2-methylphenyl)methyl)piperazine
Database identifiers
- CAS
522-18-9- PubChem CID
- 71636
- DTXSID
DTXSID80862108- ChEMBL
CHEMBL2110781- ChEBI
CHEBI:135708- UNII
- N52918SLYN
- EC Number
- 208-323-0
- Nikkaji
- J6.619B
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 15.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 503
Physicochemical properties
- Boiling point
- 0.01 · bp0.01 234-236°; bp0.005 235°
- FDA UNII
- 52918 SLYN · N52918SLYN
- ATC code
- 3 AX03 · A03AX03
Chemistry & industry
Pharmacology
ATC Code
A - Alimentary tract and metabolism
QA - Alimentary tract and metabolism
Additional notes
DefinitionChEBI: Chlorbenzoxamine is a diarylmethane.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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