PYRROLIDINO-[1,2e]-4H-2,4-DIMETHYL-1,3,5-DITHIAZINE
Grundinformationen
- CAS
116505-60-3- Standard-SMILES
C[C@H]1S[C@@H](C)N2CCC[C@H]2S1- InChIKey
OJEOXDLLIADRBL-BIIVOSGPSA-N- Summenformel
- C8H15NS2
- Durchschnittliche Molmasse
- 189,3 g/mol
- Monoisotopische Masse
- 189,06459183
Überblick
Pyrrolidino-[1,2E]-4H-2,4-dimethyl-1,3,5-dithiazine is an organic heteromonocyclic compound, an organonitrogen heterocyclic compound and an organosulfur heterocyclic compound.
Namen und Bezeichner
- Bevorzugter Name
- PYRROLIDINO-[1,2e]-4H-2,4-DIMETHYL-1,3,5-DITHIAZINE
- IUPAC
- (2S,4S,8aR)-2,4-dimethyl-6,7,8,8a-tetrahydro-4H-pyrrolo[2,1-d][1,3,5]dithiazine
- Englischer Name
- 4H-Pyrrolo2,1-d-1,3,5-dithiazine, tetrahydro-2,4-dimethyl-, 2S-(2.alpha.,4.alpha.,8a.beta.)-
- Summenformel
- C8H15NS2
- Molmasse
- 189.34
Namen und Synonyme
116505-60-3Pyrrolidino-(1,2E)-4H-2,4-dimethyl-1,3,5-dithiazineFEMA No. 4321DTC802H23E2,4-Dimethyl(4H)pyrrolidino(1,2E)-1,3,5-dithiazine2,4-Dimethyltetrahydropyrrolo(2,1-d)(1,3,5)-dithiazinePyrrolidino-(1,2E)-4H-2,4-dimethyl-1,3,5-dithiazine [FHFI]Pyrrolidino-[1,2E]-4H-2,4-dimethyl-1,3,5-dithiazine4H-PYRROLO(2,1-D)-1,3,5-DITHIAZINE, TETRAHYDRO-2,4-DIMETHYL-, (2S-(2.ALPHA.,4.ALPHA.,8A.BETA.))-4H-Pyrrolo(2,1-d)-1,3,5-dithiazine, tetrahydro-2,4-dimethyl-, (2S-(2alpha,4alpha,8abeta))-2,4-Dimethyl(4H)pyrrolidino[1,2e]-1,3,5-dithiazine2,4-DIMETHYLTETRAHYDROPYRROLO[2,1-d][1,3,5]-DITHIAZINE
Weitere Namen anzeigen
(2S,4S,8aR)-Tetrahydro-2,4-dimethyl-4H-pyrrolo[2,1-d]-1,3,5-dithiazine4H-Pyrrolo[2,1-d]-1,3,5-dithiazine, tetrahydro-2,4-dimethyl-, (2S,4S,8aR)-4H-Pyrrolo2,1-d-1,3,5-dithiazine, tetrahydro-2,4-dimethyl-, 2S-(2.alpha.,4.alpha.,8a.beta.)-
4H-Pyrrolo[2,1-d]-1,3,5-dithiazine, tetrahydro-2,4-dimethyl-, [2S-(2.alpha.,4.alpha.,8a.beta.)]-RefChem:8711032,4-dimethyl-hexahydropyrrolo(2,1-d)(1,3,5)dithiazine2,4-dimethyl-hexahydropyrrolo[2,1-d][1,3,5]dithiazine(2S,4S,8AR)-2,4-dimethyltetrahydro-4H-pyrrolo[2,1-d][1,3,5]dithiazine(2S,4S,8aR)-2,4-dimethyl-6,7,8,8a-tetrahydro-4H-pyrrolo[2,1-d][1,3,5]dithiazineUNII-DTC802H23ECHEBI:173249
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3
- Polarare Oberfläche (TPSA)
- 53,8 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 151
Experimentelle und physikochemische Eigenschaften
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Flavoring AgentsEU Flavoring substances
Solubility
Practically insoluble or insoluble in water; soluble in pentane and diethyl ether
Soluble (in ethanol)
Physical DescriptionCrystalline solid; Meaty, cooked, brown roasted aroma
Physikochemische Eigenschaften
- Siedepunkt
- 275 ℃ · 275℃ (760 Torr)
- Dichte
- 1.18 · 1.18±0.1 g/cm3 (20 ºC 760 Torr)
- FEMA
- 4321 · 4321 | PYRROLIDINO-[1,2E]-4H-2,4-DIMETHYL-1,3,5-DITHIAZINE
- Flammpunkt
- 120 ℃ · 120℃ (760 Torr)
- pka
- 5.25 · 5.25±0.60(Predicted)
- Geruch (Odor)
- 0.1 % · at 0.10 % in propylene glycol. meaty cooked roasted
- Geruchsart
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
Gefahrenhinweise
Regulatory Information
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
4H-Pyrrolo2,1-d-1,3,5-dithiazine, tetrahydro-2,4-dimethyl-, 2S-(2.alpha.,4.alpha.,8a.beta.)-: Does not have an individual approval but may be used under an appropriate group standard
Chemie und Industrie
Verwendung und Herstellung
Use Classification
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Anwendungen
OccurrenceReported found in roasted shellfish.
Anbieter2 Anbieter
湖北美索伦科技有限公司13419562052 13419562052 · [email protected]
CD Chemical Group Limited+86-13651442114 · [email protected]
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