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1-Propanone, 1-(4-methoxyphenyl)-3-(1-piperidinyl)-, hydrochloride (1:1)

HCID 70563
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
1026-88-6
Standard SMILES
COc1ccc(C(=O)CCN2CCCCC2)cc1.Cl
InChIKey
CCGBIMUGLRDVOC-UHFFFAOYSA-N
Molecular formula
C15H22ClNO2
Average molar mass
283.79 g/mol
Monoisotopic mass
283.1339066

Names & identifiers

Preferred name
1-Propanone, 1-(4-methoxyphenyl)-3-(1-piperidinyl)-, hydrochloride (1:1)
IUPAC
1-(4-methoxyphenyl)-3-piperidin-1-ylpropan-1-one;hydrochloride
English name
1-Propanone,1-(4-methoxyphenyl)-3-(1-piperidinyl)-, hydrochloride (1:1)
Molecular formula
C15H22ClNO2
Molecular weight
283.8

Names & synonyms

1-Propanone, 1-(4-methoxyphenyl)-3-(1-piperidinyl)-, hydrochloride (1:1)RefChem:4363021026-88-6Propiophenone, 4'-methoxy-3-piperidino-, hydrochlorideWLN: T6NTJ A2VR DO1 &GH1-(4-METHOXYPHENYL)-3-(PIPERIDIN-1-YL)PROPAN-1-ONE HYDROCHLORIDECHEMBL3337635NSC 70237NSC 352824-Methoxy-.beta.-(1-piperidyl)propiophenone hydrochloride4-Methoxy-beta-(1-piperidyl)propiophenone hydrochloridePropiophenone, 4'-methoxy-beta-(1-piperidino)-, hydrochloride
Show more names
N-piperidinium chloride1-(4-METHOXYPHENYL)-3-(1-PIPERIDINYL)-1-PROPANONE HYDROCHLORIDE1-Propanone,1-(4-methoxyphenyl)-3-(1-piperidinyl)-, hydrochloride (1:1)
1-Propanone, 1-(4-methoxyphenyl)-3-(1-piperidinyl)-, hydrochlorideDTXSID401453481-(4-methoxyphenyl)-3-piperidin-1-ylpropan-1-one;hydrochlorideNSC35282NSC70237NSC-35282NSC-70237AKOS024405123

Properties

Computed structural properties

Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
19
Formal charge
0
Complexity
253

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Chemistry & industry

Suppliers2 total

吉林中科研伸科技有限公司18143011203 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
1026-88-6
PubChem CID
70563
DTXSID
DTXSID40145348
ChEMBL
CHEMBL3337635
EC Number
103-463-8