2-Methylmorpholine

HCID 410615CAS 27550-90-9

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Grundinformationen

Standard-SMILES: CC1CNCCO1
InChIKey: LQMMFVPUIVBYII-UHFFFAOYSA-N
Summenformel: C5H11NO
Durchschnittliche Molmasse: 101,15 g/mol
Monoisotopische Masse: 101,08406397

Namen und Bezeichner

Bevorzugter Name: 2-Methylmorpholine
IUPAC: 2-methylmorpholine
Englischer Name: 2-Methylmorpholine
Summenformel: C5H11NO
Molmasse: 101.15

Namen und Synonyme

2-methylmorpholine27550-90-9DTXSID50328468RefChem:263884DTXCID20279574804-924-22-Methyl-morpholinemorpholine, 2-methyl-MFCD08444368(R)-2-Methyl-morpholine2-MethylMoupholine(2R)-2-methyl-morpholine

Weitere Namen anzeigen

2-METHYLMORPHOLINE HCLrac 2-Methyl-morpholine, 98%2-METHYLMORPHOLINE HYDROCHLORIDE

SCHEMBL4620SCHEMBL16695SCHEMBL392279SCHEMBL667084SCHEMBL1776060SCHEMBL2040620SCHEMBL2041006SCHEMBL2042950

Datenbank-Bezeichner

CAS: 27550-90-9
PubChem CID: 410615
DTXSID: DTXSID50328468
EC Number: 804-924-2
Nikkaji: J1.592.555H

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -0,1
Polarare Oberfläche (TPSA): 21,3 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 0
Schwere Atome: 7
Formalladung: 0
Komplexität: 56

Physikochemische Eigenschaften

Siedepunkt: 135 · 135-136 °C
Dichte: 0.939 g/cm3 · 0.939 g/cm3(Temp: 25 °C)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka: 9.01 · 9.01±0.40(Predicted)
Aggregatzustand: liquid
Farbe: Colourless to light yellow
InChI: 1S/C5H11NO/c1-5-4-6-2-3-7-5/h5-6H,2-4H2,1H3
InChIKey: LQMMFVPUIVBYII-UHFFFAOYSA-N
SMILES: CC1CNCCO1

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H226 (25%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesFlam. Liq. 3 (25%)

Sicherheitsdaten

ridadr: 2920
hs_code: 2934999090
packing_group: Ⅱ
Speicherklasse: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
Hazard Classifications: Acute Tox. 3 Oral