1-methyl-1H-1,2,4-triazole-3-carboxylic acid
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Grundinformationen
- CAS
815588-82-0- Standard-SMILES
Cn1cnc(C(=O)O)n1- InChIKey
PMEKKJJZHNQEIZ-UHFFFAOYSA-N- Summenformel
- C4H5N3O2
- Durchschnittliche Molmasse
- 127,1 g/mol
- Monoisotopische Masse
- 127,03817641
Namen und Bezeichner
- Bevorzugter Name
- 1-methyl-1H-1,2,4-triazole-3-carboxylic acid
- IUPAC
- 1-methyl-1,2,4-triazole-3-carboxylic acid
- Englischer Name
- 1-Methyl-1H-1,2,4-triazole-3-carboxylic acid
- Summenformel
- C4H5N3O2
- Molmasse
- 127.1
Namen und Synonyme
1-Methyl-1H-1,2,4-triazole-3-carboxylic acid815588-82-0RefChem:433798816-625-41-methyl-1,2,4-triazole-3-carboxylic acidMFCD180726811H-1,2,4-Triazole-3-carboxylic acid, 1-methyl-SCHEMBL341930SCHEMBL1431215PMEKKJJZHNQEIZ-UHFFFAOYSA-NR66L24P47UALBB-032094
Weitere Namen anzeigen
AKOS006384839AS-39725DA-29248SY124461CS-00372691-methyl-1,2,4-tri-azole-3-carboxylic acid1-Methyl-1H-1,2,4-triazole-3-carboxylicacidEN300-214172
Datenbank-Bezeichner
- CAS
815588-82-0- PubChem CID
- 21981802
- UNII
- R66L24P47U
- EC Number
- 816-625-4
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- -0,1
- Polarare Oberfläche (TPSA)
- 68 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 127
Physikochemische Eigenschaften
- storage temp.
- 2 · 2-8°C
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]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；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, 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 CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Sicherheitsdaten
- hs_code
- 2933998090
Chemie und Industrie
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