3-(((4-Iodobenzyl)oxy)methyl)piperidine hydrochloride
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Basic information
- CAS
1219979-15-3- Standard SMILES
Cl.Ic1ccc(COCC2CCCNC2)cc1- InChIKey
KRGHAWHGDGNZGO-UHFFFAOYSA-N- Molecular formula
- C13H19ClINO
- Average molar mass
- 367.65 g/mol
- Monoisotopic mass
- 367.01999
Names & identifiers
- Preferred name
- 3-(((4-Iodobenzyl)oxy)methyl)piperidine hydrochloride
- IUPAC
- 3-[(4-iodophenyl)methoxymethyl]piperidine;hydrochloride
- English name
- 4-Iodobenzyl 3-piperidinylmethyl etherhydrochloride
- Molecular formula
- C13H19ClINO
- Molecular weight
- 367.66
Names & synonyms
1219979-15-33-(((4-Iodobenzyl)oxy)methyl)piperidine hydrochloride4-Iodobenzyl 3-piperidinylmethyl ether hydrochloride4-Iodobenzyl 3-piperidinylmethyl etherhydrochloride3-[(4-iodophenyl)methoxymethyl]piperidine;hydrochlorideAKOS0158477833-(((4-Iodobenzyl)oxy)methyl)piperidinehydrochloride
Database identifiers
- CAS
1219979-15-3- PubChem CID
- 56831215
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 192
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
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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