CAS 1440-60-4 2-Chloro-1-piperidine-1-yl-ethanone (HCID 222312)

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Basic information

CAS: 1440-60-4
Standard SMILES: O=C(CCl)N1CCCCC1
InChIKey: NSWLMOHUXYULKL-UHFFFAOYSA-N
Molecular formula: C7H12ClNO
Average molar mass: 161.63 g/mol
Monoisotopic mass: 161.06074168

Names & identifiers

Preferred name: 2-Chloro-1-piperidine-1-yl-ethanone
IUPAC: 2-chloro-1-piperidin-1-ylethanone
English name: 2-CHLORO-1-PIPERIDIN-1-YL-ETHANONE
Molecular formula: C7H12ClNO
Molecular weight: 161.63

Names & synonyms

2-Chloro-1-piperidine-1-yl-ethanoneRefChem:468518604-393-51440-60-41-(Chloroacetyl)piperidine2-chloro-1-(piperidin-1-yl)ethanone2-Chloro-1-piperidin-1-yl-ethanone2-chloro-1-(piperidin-1-yl)ethan-1-one2-chloro-1-piperidin-1-ylethanoneMFCD01095825Piperidine, 1-(chloroacetyl)-pipridine

Show more names

LABOTEST-BB LT00000083Pipridine, 1-chloroacetyl-2-chloro-1-piperidino-ethanonePiperidine, N-[2-chloroacetyl]-2-CHLORO-1-PIPERIDINE ACETAMIDE2-chloro-1-(1-piperidyl)ethanone

Ethanone, 2-chloro-1-(1-piperidinyl)-SCHEMBL483521-(Chloroacetyl)piperidine #CHEMBL54408902-chloro-1-(1-piperidinyl)ethanone1-(piperidin-1-yl)-2-chloroethanoneGS-6016SB41339

Database identifiers

CAS: 1440-60-4
PubChem CID: 222312
DTXSID: DTXSID60278546
ChEMBL: CHEMBL5440890
EC Number: 604-393-5
Nikkaji: J246.862J

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 20.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 121

Physicochemical properties

Boiling point: 85 °C/0.08mm · 85°C/0.08mm
storage temp.: 2 · Storage temp. 2-8°C
form: liquid
color: Yellow
CAS DataBase Reference: 1440 · 1440-60-4(CAS DataBase Reference)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
HS Code: 29333990 · 29333990

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (92.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (92.7%)

Safety data

hs_code: 29333990
Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H315-H319
Precautionary statements: P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313