3,4-Dihydro-2H-pyrrol

1-PYRROLINE · Einecs 227-230-6 · delta(1)-pyrroline · 3,4-dihydro-2H-pyrrole · 2H-Pyrrole, 3,4-dihydro-

Identifikatoren & physikalische Daten

CAS No.	5724-81-2
Summenformel	C4H7N
Durchschnittliche Molmasse	69,11 g/mol
Monoisotopische Masse	69,05784922 g/mol
SMILES	C1=NCCC1
InChIKey	ZVJHJDDKYZXRJI-UHFFFAOYSA-N
PubChem CID	79803
ChEBI	CHEBI:19092
EC No.	227-230-6
DTXSID	DTXSID10863608
Lokaler Name	3,4-Dihydro-2H-pyrrol

XLogP	-0,3
Polarare Oberfläche (TPSA)	12,4
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	1
Frei drehbare Bindungen	0
Schwere Atome	5
Formalladung	0
Komplexität	47,6
SpringerMaterials Properties	Coriolis coupling
Lebensmittelzusatzstoffe	FLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Dichte	0.849-0.8550.95±0.1 g/cm3(Predicted)
Aromastoffe	EU Flavoring substances
Löslichkeit	Soluble in waterSoluble (in ethanol)
Siedepunkt	87.00 to 89.00 °C. @ 760.00 mm Hg87-89 °C113.7±13.0 °C(Predicted)
Brechungsindex	1.440-1.446
Physical Description	SolidColourless liquidPungent ammoniacal odour
Schmelzpunkt	96-102 °C
FEMA	3898 \| 1-PYRROLINE
pKa (Säurekonstante)	7.81±0.20(Predicted)
Geruch	at 0.10 % in propylene glycol. ammoniacal shrimp seafood
Geruchsart	ammoniacal
JECFA Number	1603
Henry-Konstante	1.6×100 mol/(m3Pa) at 25℃, Amoore and Buttery (1978)
LogP (Verteilungskoeffizient)	-0.78

GHS-Einstufung	This chemical does not meet GHS hazard criteria for 100% (89 of 89) of all reports.Not ClassifiedAggregated GHS information provided per 89 reports by companies from 1 notifications to the ECHA C&L Inventory.
Regulatorische Informationen	Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
Hazard Classes and Categories	Not Classified
Alarmwort	Achtung
Gefahrenhinweise	Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H225