(3R)-(+)-3-(Dimethylamino)pyrrolidine

HCID 2758521CAS 132958-72-6

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Grundinformationen

Standard-SMILES: CN(C)[C@@H]1CCNC1
InChIKey: AVAWMINJNRAQFS-ZCFIWIBFSA-N
Summenformel: C6H14N2
Durchschnittliche Molmasse: 114,19 g/mol
Monoisotopische Masse: 114,11569845

Namen und Bezeichner

Bevorzugter Name: (3R)-(+)-3-(Dimethylamino)pyrrolidine
IUPAC: (3R)-N,N-dimethylpyrrolidin-3-amine
Englischer Name: (3R)-(+)-3-(Dimethylamino)pyrrolidine
Summenformel: C6H14N2
Molmasse: 114.19

Namen und Synonyme

(3R)-(+)-3-(Dimethylamino)pyrrolidineRefChem:400720626-139-2132958-72-6(R)-N,N-dimethylpyrrolidin-3-amine(R)-(+)-3-(Dimethylamino)pyrrolidine(R)-3-Dimethylaminopyrrolidine(3R)-N,N-dimethylpyrrolidin-3-amineMFCD00191347(3R)-N,N-Dimethyl-3-pyrrolidinamine(r)-3-(dimethylamino)pyrrolidine3-Pyrrolidinamine, N,N-dimethyl-, (3R)-

Weitere Namen anzeigen

(3R)-NJACS-132958-72-6(3R)-(+)-3-(DIMETHYLR- N,N-diMethyl-3-PyrrolidinaMine(R)-DIMETHYL-PYRROLIDIN-3-YL-AMINE(3R)-DIMETHYL-PYRROLIDIN-3-YL-AMINE

(3r)-3-dimethylaminopyrrolidineSCHEMBL1326853-(R)-(dimethylamino)pyrrolidinedimethyl(r)-pyrrolidin-3-yl-amine(r)-n,n-dimethyl-3-pyrrolidinamineAC-25958AFH8VQ5JVSCHEMBL491774

Datenbank-Bezeichner

CAS: 132958-72-6
PubChem CID: 2758521
DTXSID: DTXSID50374369
UNII: 8AFH8VQ5JV
EC Number: 626-139-2
Nikkaji: J382.976F

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0
Polarare Oberfläche (TPSA): 15,3 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 8
Formalladung: 0
Komplexität: 70,9

Physikochemische Eigenschaften

Siedepunkt: 166 °C760 · 166 °C760 mm Hg(lit.)
Dichte: 0.899 g/mL · 0.899 g/mL at 25 °C(lit.)
Brechungsindex: 20 · n20/D 1.4650(lit.)
Flammpunkt: 125 °F · 125 °F
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
Aggregatzustand: clear liquid
pka: 9.93 · 9.93±0.10(Predicted)
Farbe: Colorless to Light yellow
InChI: InChI=1S/C6H14N2/c1-8(2)6-3-4-7-5-6/h6-7H,3-5H2,1-2H3/t6-/m1/s1
InChIKey: AVAWMINJNRAQFS-ZCFIWIBFSA-N
SMILES: N1CC[C@@H](N(C)C)C1
CAS Datenbank: 132958 · 132958-72-6(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P332+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 48 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Sicherheitsdaten

wgk: 2
ridadr: UN 1993 3/PG 3
hs_code: 29339900
risk_code: 10-22-37/38-41-38-37
hazard_code: Xn
safety_code: 26-36/39-39-36
hazard_class: 3
packing_group: III
Speicherklasse: 3 - Flammable liquids
Hazard Classifications: Acute Tox. 4 OralEye Dam. 1Flam. Liq. 3Skin Irrit. 2STOT SE 3