2,4-Dimethyl-4-methyl-3H-1,2,4-triazol-3-thion
3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-methyl-
Grundinformationen
- CAS
24854-43-1- Standard-SMILES
Cn1cn[nH]c1=S- InChIKey
AGWWTUWTOBEQFE-UHFFFAOYSA-N- Summenformel
- C3H5N3S
- Durchschnittliche Molmasse
- 115,16 g/mol
- Monoisotopische Masse
- 115,02041816
Namen und Bezeichner
- Bevorzugter Name
- 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-methyl-
- IUPAC
- 4-methyl-1H-1,2,4-triazole-5-thione
- Lokaler Name
- 2,4-Dimethyl-4-methyl-3H-1,2,4-triazol-3-thion
- Englischer Name
- 4-Methyl-1,2,4-triazole-3-thiol
- Summenformel
- C3H5N3S
- Molmasse
- 115.16
Namen und Synonyme
24854-43-14-Methyl-4H-1,2,4-triazole-3-thiol3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-methyl-EINECS 246-496-42,4-Dimethyl-4-methyl-3H-1,2,4-triazole-3-thione1,4-Dihydro-4-methyl-3H-1,2,4-triazole-3-thioneDTXSID30670273H-1,2,4-Triazole-3-thione, 1,4-dihydro-4-methyl-RefChem:505604DTXCID4037160246-496-43-Mercapto-4-methyl-4H-1,2,4-triazole
Weitere Namen anzeigen
TIMTEC-BB SBB0075783-Mercapto-4-methyl-4H-1,2,4-t4-Methyl-3-mercapto-1,2,4-triazoleMERCAPTO(3-)-4-METHYL-1,2,4-TRIAZOLE4-Methyl-4H-3-mercapto-1,2,4-triazole
3-Mercapto-4-methyl-1,2,4-triazole4-methyl-1,2,4-triazole-3-thiol4-methyl-1H-1,2,4-triazole-5-thioneMFCD000100692,4-dihydro-4-methyl-3H-1,2,4-triazole-3-thione4-methyl-4,5-dihydro-1H-1,2,4-triazole-5-thione4-Methyl-1,2,4-triazolethione4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Datenbank-Bezeichner
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0
- Polarare Oberfläche (TPSA)
- 59,7 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 7
- Formalladung
- 0
- Komplexität
- 119
Physikochemische Eigenschaften
- Schmelzpunkt
- 165 · 165-169°C
- Siedepunkt
- 135.3 · 135.3±23.0 °C(Predicted)
- Dichte
- 1.44 · 1.44±0.1 g/cm3(Predicted)
- storage temp.
- Inert atmosphere,Room Temperature
- Löslichkeit
- 2.5 %, · acetone: soluble2.5%, clear, colorless to faintly yellow
- Aggregatzustand
- powder to crystal
- pka
- 9.73 · 9.73±0.20(Predicted)
- Farbe
- White to Light yellow
- BRN
- 110580 · 110580
- InChI
- InChI=1S/C3H5N3S/c1-6-2-4-5-3(6)7/h2H,1H3,(H,5,7)
- InChIKey
- AGWWTUWTOBEQFE-UHFFFAOYSA-N
- SMILES
- N1=CN(C)C(=S)N1
- CAS Datenbank
- 24854 · 24854-43-1(CAS DataBase Reference)
- EPA chemische Informationen
- 3 H-1,2,4-Triazole-3-thione, · 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-methyl- (24854-43-1)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 48 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 2933998090
- RTECS-Nr.
- XZ5359126
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36/37/39
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-methyl-: ACTIVE
Anbieter84 Anbieter
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
江苏星科元信息科技有限公司400-605-7200 15335295587 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
衢州明锋化工有限公司0570-3062502 13819002126;13819008176 · [email protected]
Syntechem Co.,Ltd[email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
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