4-(4-Methyl-4H-1,2,4-Triazol-3-Yl)Aniline
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Grundinformationen
- CAS
690632-18-9- Standard-SMILES
Cn1cnnc1-c1ccc(N)cc1- InChIKey
FUZWWFVYRMIXMT-UHFFFAOYSA-N- Summenformel
- C9H10N4
- Durchschnittliche Molmasse
- 174,2 g/mol
- Monoisotopische Masse
- 174,09054634
Namen und Bezeichner
- Bevorzugter Name
- 4-(4-Methyl-4H-1,2,4-Triazol-3-Yl)Aniline
- IUPAC
- 4-(4-methyl-1,2,4-triazol-3-yl)aniline
- Englischer Name
- 4-(4-METHYL-4H-1,2,4-TRIAZOL-3-YL)ANILINE
- Summenformel
- C9H10N4
- Molmasse
- 174.2
Namen und Synonyme
4-(4-methyl-4H-1,2,4-triazol-3-yl)aniline690632-18-9DTXSID90383410RefChem:514379DTXCID60334434109-000-6687-632-64-(4-methyl-1,2,4-triazol-3-yl)anilineBenzenamine,4-(4-methyl-4H-1,2,4-triazol-3-yl)-MFCD062008854-(4-methyl-1,2,4-triazol-3-yl)phenylamine[4-(4-methyl-4H-1,2,4-triazol-3-yl)phenyl]amine
Weitere Namen anzeigen
TIMTEC-BB SBB0054034-(4-Methyl-4H-1,2,4-triazol-3-yl)aniline95%[4-(4-methyl-1,2,4-triazol-3-yl)phenyl]amine3-(4-Aminophenyl)-4-methyl-4H-1,2,4-triazole4-(4-Methyl-4H-1,2,4-triazol-3-yl)aniline90%4-(4-Methyl-4H-1,2,4-triazol-3-yl)aniline 90%
TimTec1_004161SCHEMBL62239Benzenamine, 4-(4-methyl-4H-1,2,4-triazol-3-yl)-HMS1545N03ALBB-025614SBB005403STK803105AKOS003375495
Datenbank-Bezeichner
- CAS
690632-18-9- PubChem CID
- 2794785
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 0,4
- Polarare Oberfläche (TPSA)
- 56,7 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 13
- Formalladung
- 0
- Komplexität
- 165
Physikochemische Eigenschaften
- Siedepunkt
- 394.3 · 394.3±44.0 °C(Predicted)
- Dichte
- 1.27 · 1.27±0.1 g/cm3(Predicted)
- pka
- 3.25 · 3.25±0.10(Predicted)
- Aggregatzustand
- solid
- Farbe
- Orange
- InChI
- 1S/C9H10N4/c1-13-6-11-12-9(13)7-2-4-8(10)5-3-7/h2-6H,10H2,1H3
- InChIKey
- FUZWWFVYRMIXMT-UHFFFAOYSA-N
- SMILES
- Cn1cnnc1-c2ccc(N)cc2
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, 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.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Hazard Classes and Categories
Acute Tox. 4 (100%)；Acute Tox. 4 (50%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；Acute Tox. 4 (50%)；STOT SE 3 (100%)
Acute Tox. 3 (100%)
Sicherheitsdaten
- wgk
- WGK 3
- hs_code
- 2933998090
- risk_code
- 25
- hazard_code
- T
- hazard_note
- Harmful
Chemie und Industrie
Anbieter11 Anbieter
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