2-Piperidinone, 1,5-dimethyl-

HCID 159027

Notizen Reaktionen

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

CAS: 86917-58-0
Standard-SMILES: CC1CCC(=O)N(C)C1
InChIKey: YXHVIDNQBMVYHQ-UHFFFAOYSA-N
Summenformel: C7H13NO
Durchschnittliche Molmasse: 127,18 g/mol
Monoisotopische Masse: 127,09971404

Namen und Bezeichner

Bevorzugter Name: 2-Piperidinone, 1,5-dimethyl-
IUPAC: 1,5-dimethylpiperidin-2-one
Englischer Name: 1,5-Dimethyl-2-piperidone
Summenformel: C7H13NO
Molmasse: 127.18

Namen und Synonyme

1,5-Dimethyl-2-piperidone86917-58-02-Piperidinone, 1,5-dimethyl-DTXSID10888679RefChem:478294DTXCID501027955679-997-51,5-dimethylpiperidin-2-oneMFCD03701098SCHEMBL583977AKOS015850788SY052843

Weitere Namen anzeigen

1,5-Dimethyl-2-piperidone>1,5-Dimethyl-piperidin-2-one

CS-0358054D2753D90110F750408

Datenbank-Bezeichner

CAS: 86917-58-0
PubChem CID: 159027
DTXSID: DTXSID10888679
EC Number: 679-997-5
Nikkaji: J1.326.056G

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,6
Polarare Oberfläche (TPSA): 20,3 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 0
Schwere Atome: 9
Formalladung: 0
Komplexität: 122

Physikochemische Eigenschaften

Siedepunkt: 232.6 °C · 232.6 °C
Dichte: 0.949 · 0.949±0.06 g/cm3(Predicted)
Flammpunkt: 94 °C · 94 °C
Aggregatzustand: clear liquid
pka: -0.37 · -0.37±0.40(Predicted)
Farbe: Colorless to Light yellow
EPA chemische Informationen: 2 · 2-Piperidinone, 1,5-dimethyl- (86917-58-0)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

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

Gefahrenhinweise

Regulatory Information · 2 Einträge

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

2-Piperidinone, 1,5-dimethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)

Regulatorische Informationen

Regulatory Information · 2 Einträge

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

2-Piperidinone, 1,5-dimethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.