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HCID 111913Erstellt: 3. November 2026

N-[3-(Dimethylamino)propyl]tridecafluorhexansulfonamid

N-AP-FHxSA in Methanol · N-[3-(Dimethylamino)propyl]perfluoro-1-hexanesulfonamide · N-[3-(dimethylamino)propyl]tridecafluorohexanesulphonamide · N-[3-(Dimethylamino)propyl] Perfluorohexanesulfonamide (>85%) · N-(3-dimethylaminopropan-1-yl)perfluoro-1-hexanesulfonamide 1.2 mL 50.0 μg/mL · N-[3-(Dimethylamino)propyl]-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane sulfonamide · N-(3-(dimethylamino)propyl)-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane-1-sulfonamide · N-[3-(Dimethylamino)propyl]-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-1-hexanesulfonamide

https://huagongshe.com/de/chemical/111913

Molekülstruktur von N-[3-(Dimethylamino)propyl]tridecafluorhexansulfonamid

Identifikatoren & physikalische Daten

CAS No.	50598-28-2
Summenformel	C6F13SO2NHCH2CH2CH2N(CH3)2
Durchschnittliche Molmasse	484,28 g/mol
Monoisotopische Masse	484,0490149 g/mol
SMILES	CN(C)CCCNS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIKey	INDOGKYZYLAGEM-UHFFFAOYSA-N
PubChem CID	111913
EC No.	256-639-2
DTXSID	DTXSID7068556
Lokaler Name	N-[3-(Dimethylamino)propyl]tridecafluorhexansulfonamid

Chemische & physikalische Eigenschaften

XLogP	4,3
Polarare Oberfläche (TPSA)	57,8
H-Brücken-Donoren	1
H-Brücken-Akzeptoren	17
Frei drehbare Bindungen	10
Schwere Atome	29
Formalladung	0
Komplexität	667
PFAS	PFAS -> PerfluoroalkylsulfonamidesPFAS -> Other/unspecifiedPFAS -> non-polymerPFAS -> OECD CategoryPFAS -> Cationic/Zwitterionic PFAS AFFF
Collision Cross Section	182.8 Å² [M-H]- [CCS Type: DTBuffer gas: N2Ionization: ESI-Dataset: PFAS]
Siedepunkt	291.0±50.0 °C(Predicted)
Dichte	1.521±0.06 g/cm3(Predicted)
Löslichkeit	Chloroform (Slightly), Methanol (Slightly)
Aggregatzustand	Solid
pKa (Säurekonstante)	5.46±0.40(Predicted)
Farbe	White to Off-White
Henry-Konstante	7.7×10-2 mol/(m3Pa) at 25℃, Zhang et al. (2010)
EPA chemische Informationen	1-Hexanesulfonamide, N-[3-(dimethylamino)propyl]-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro- (50598-28-2)

Sicherheit & Vorschriften

Regulatorische Informationen	S - indicates a substance that is identified in a final Significant New Use Rule.Substance: N-[3-(dimethylamino)propyl]tridecafluorohexanesulphonamide
TSCA-Inventar-Status	TSCA listed

N-[3-(Dimethylamino)propyl]tridecafluorhexansulfonamid

Identifikatoren & physikalische Daten

CAS No.

50598-28-2

Summenformel

C6F13SO2NHCH2CH2CH2N(CH3)2

Durchschnittliche Molmasse

484,28 g/mol

Monoisotopische Masse

484,0490149 g/mol

SMILES

CN(C)CCCNS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

InChIKey

INDOGKYZYLAGEM-UHFFFAOYSA-N

PubChem CID

111913

EC No.

256-639-2

DTXSID

DTXSID7068556

Lokaler Name

N-[3-(Dimethylamino)propyl]tridecafluorhexansulfonamid

Chemische & physikalische Eigenschaften

XLogP

4,3

Polarare Oberfläche (TPSA)

57,8

H-Brücken-Donoren

H-Brücken-Akzeptoren

Frei drehbare Bindungen

Schwere Atome

Formalladung

Komplexität

667

PFAS

PFAS -> PerfluoroalkylsulfonamidesPFAS -> Other/unspecifiedPFAS -> non-polymerPFAS -> OECD CategoryPFAS -> Cationic/Zwitterionic PFAS AFFF

Collision Cross Section

182.8 Å² [M-H]- [CCS Type: DTBuffer gas: N2Ionization: ESI-Dataset: PFAS]

Siedepunkt

291.0±50.0 °C(Predicted)

Dichte

1.521±0.06 g/cm3(Predicted)

Löslichkeit

Chloroform (Slightly), Methanol (Slightly)

Aggregatzustand

Solid

pKa (Säurekonstante)

5.46±0.40(Predicted)

Farbe

White to Off-White

Henry-Konstante

7.7×10-2 mol/(m3Pa) at 25℃, Zhang et al. (2010)

EPA chemische Informationen

1-Hexanesulfonamide, N-[3-(dimethylamino)propyl]-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro- (50598-28-2)

Regulatorische Informationen

S - indicates a substance that is identified in a final Significant New Use Rule.Substance: N-[3-(dimethylamino)propyl]tridecafluorohexanesulphonamide

TSCA-Inventar-Status

TSCA listed