Basic information
- CAS
1185297-69-1- Standard SMILES
Cl.Clc1cccc(OCC2CCNCC2)c1- InChIKey
ASXBAVLNZAPPII-UHFFFAOYSA-N- Molecular formula
- C12H17Cl2NO
- Average molar mass
- 262.17 g/mol
- Monoisotopic mass
- 261.0687196
Names & identifiers
- Preferred name
- 4-[(3-Chlorophenoxy)methyl]piperidine hydrochloride
- IUPAC
- 4-[(3-chlorophenoxy)methyl]piperidine;hydrochloride
- English name
- 4-[(3-CHLOROPHENOXY)METHYL]PIPERIDINEHYDROCHLORIDE
- Molecular formula
- C12H17Cl2NO
- Molecular weight
- 262.17
Names & synonyms
1185297-69-14-[(3-Chlorophenoxy)methyl]piperidine hydrochloride4-((3-chlorophenoxy)methyl)piperidine hydrochloride4-[(3-chlorophenoxy)methyl]piperidine;hydrochloride4-[(3-Chlorophenoxy)methyl]piperidinehydrochlorideMFCD09879197Piperidine, 4-[(3-chlorophenoxy)methyl]-, hydrochloride (1:1)4-((3-chlorophenoxy)methyl)piperidine HClAKOS015846117CS-0442049F20031A1-06162
Database identifiers
- CAS
1185297-69-1- PubChem CID
- 45075355
Properties
Computed structural properties
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 182
Physicochemical properties
- Hazard Codes
- Xi
- 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_code
- Xi
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers1 total
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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