Basic information
- CAS
1220038-88-9- Standard SMILES
Brc1ccc(COCCC2CCCNC2)cc1.Cl- InChIKey
NJQJDCVLRHQZJH-UHFFFAOYSA-N- Molecular formula
- C14H21BrClNO
- Average molar mass
- 334.68 g/mol
- Monoisotopic mass
- 333.0495
Names & identifiers
- Preferred name
- 3-(2-((4-Bromobenzyl)oxy)ethyl)piperidine hydrochloride
- IUPAC
- 3-[2-[(4-bromophenyl)methoxy]ethyl]piperidine;hydrochloride
- English name
- 3-{2-[(4-Bromobenzyl)oxy]ethyl}piperidinehydrochloride
- Molecular formula
- C14H21BrClNO
- Molecular weight
- 334.68
Names & synonyms
1220038-88-93-(2-((4-Bromobenzyl)oxy)ethyl)piperidine hydrochloride3-{2-[(4-Bromobenzyl)oxy]ethyl}piperidine hydrochloride3-{2-[(4-Bromobenzyl)oxy]ethyl}piperidinehydrochloride3-[2-[(4-bromophenyl)methoxy]ethyl]piperidine;hydrochloride3-(2-((4-Bromobenzyl)oxy)ethyl)piperidinehydrochlorideAKOS015843567
Database identifiers
- CAS
1220038-88-9- PubChem CID
- 56830515
Properties
Computed structural properties
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 204
Physicochemical properties
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers2 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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