1-Benzylpiperidin-4-one--hydrogen chloride (1/1)
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Basic information
- CAS
20821-52-7- Standard SMILES
Cl.O=C1CCN(Cc2ccccc2)CC1- InChIKey
IPFLWJCPYGCLHG-UHFFFAOYSA-N- Molecular formula
- C12H16ClNO
- Average molar mass
- 225.71 g/mol
- Monoisotopic mass
- 225.09204181
Names & identifiers
- Preferred name
- 1-Benzylpiperidin-4-one--hydrogen chloride (1/1)
- IUPAC
- 1-benzylpiperidin-4-one;hydrochloride
- English name
- 1-Benzylpiperidin-4-one hydrochloride
- Molecular formula
- C12H16ClNO
- Molecular weight
- 225.71
Names & synonyms
DTXSID806229011-Benzylpiperidin-4-one--hydrogen chloride (1/1)RefChem:1054999DTXCID705736551-Benzylpiperidin-4-one hydrochloride20821-52-74-Piperidinone, 1-(phenylmethyl)-, hydrochloride (1:1)1-Benzyl-4-piperidinone hydrochloride1-benzylpiperidin-4-one;hydrochlorideN-Benzyl-4-piperidone hydrochlorideMFCD06798151ZVM47LY75M
Show more names
N-Benzyl-4-piperidone.HCl1-BENZYL-4-PIPERIDONE HCL1-Benzyl-4-oxopiperidine hydrochloride
1-(phenylmethyl)-4-piperidinone hydrochloride1-benzyl-4-piperidone hydrochloride1-Benzylpiperidin-4-one HCl4-Piperidinone, 1-(phenylmethyl)-, hydrochloride1-benzylpiperidin-4-one,hydrochlorideUNII-ZVM47LY75MSCHEMBL5671727IPFLWJCPYGCLHG-UHFFFAOYSA-N
Database identifiers
- CAS
20821-52-7- PubChem CID
- 22145482
- DTXSID
DTXSID80622901- UNII
- ZVM47LY75M
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 186
Physicochemical properties
- Melting point
- 159 · 159-161 °C
- storage temp.
- Sealed in dry,Room Temperature
- FDA UNII
- 47 LY75M · ZVM47LY75M
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2933399990 · 2933399990
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
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
1 records
Compound notes
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