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HCID 81663Erstellt: 31. Oktober 2026

3-(Propylamino)propanenitrile

LABOTEST-BB LTBB000408 · N-Cyanoethyl-N-propylamine · 3-(PROPYLAMINO)PROPIONITRILE · 3-(Propylamino)propanenitrile · 3-(propylamino)-propanenitril · N-(beta-Cyanoethyl)propylamine · 3-(Propylamino)propiononitrile · Propionitrile, 3-(propylamino)-

https://huagongshe.com/de/chemical/81663

Molekülstruktur von 3-(Propylamino)propanenitrile

Identifikatoren & physikalische Daten

CAS No.7249-87-8
SummenformelC6H12N2
Durchschnittliche Molmasse112,17 g/mol
Monoisotopische Masse112,10004839 g/mol
SMILESCCCNCCC#N
InChIKeyMZQXEAUWIMFFCG-UHFFFAOYSA-N
PubChem CID81663
EC No.673-675-8
DTXSIDDTXSID7064605

Chemische & physikalische Eigenschaften

XLogP0,4
Polarare Oberfläche (TPSA)35,8
H-Brücken-Donoren1
H-Brücken-Akzeptoren2
Frei drehbare Bindungen4
Schwere Atome8
Formalladung0
Komplexität79,8
SpringerMaterials PropertiesSurface tension
Siedepunkt119-121°C 30mm
Dichte0,86 g/cm3
Lagerbedingungen2-8°C(protect from light)
pKa (Säurekonstante)8.62±0.19(Predicted)
Aggregatzustandsolid
InChI1S/C6H12N2/c1-2-5-8-6-3-4-7/h8H,2-3,5-6H2,1H3
InChIKeyMZQXEAUWIMFFCG-UHFFFAOYSA-N
EPA chemische InformationenPropanenitrile, 3-(propylamino)- (7249-87-8)

Sicherheit & Vorschriften

GHS-EinstufungDangerH227 (50%): Combustible liquid [Warning Flammable liquids]P210, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and CategoriesFlam. Liq. 4 (50%)
Wassergefährdungsklasse (WGK)WGK 3
TSCA-Inventar-StatusTSCA listed
UN-Transportnummer2734
R-Sätze (R)34-36/37/38
GefahrensymboleXi
Sicherheitshinweise (S)26-36/37/39
GefahrenklasseIRRITANTAcute Tox. 4 OralEye Irrit. 2Skin Irrit. 2Skin Sens. 1
Lagerklasse11 - Combustible Solids