CDS000474

Thiamine nitrate

Aldrich^CPR

• Synonim(y): Vitamin B1 nitrate
• Wzór empiryczny (zapis Hilla): C₁₂H₁₇N₅O₄S
• Numer CAS: 532-43-4
• Masa cząsteczkowa: 327.36
• Beilstein: 3857790
• Numer WE: 208-537-4
• Numer MDL: MFCD00036330
• Kod UNSPSC: 12352116
• Identyfikator substancji w PubChem: 329777810

Właściwości

• mp: 374-392 °C
• ciąg SMILES: [O-][N+]([O-])=O.CC1=NC=C(C[N+]2=CSC(CCO)=C2C)C(N)=N1
• InChI: 1S/C12H17N4OS.NO3/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13;2-1(3)4/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15);/q+1;-1
• Klucz InChI: UIERGBJEBXXIGO-UHFFFAOYSA-N

Opis

Inne uwagi

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Informacja o środkach bezpieczeństwa

• Kod klasy składowania: 11 - Combustible Solids
• Klasa zagrożenia wodnego (WGK): WGK 1
• Temperatura zapłonu (°F): Not applicable
• Temperatura zapłonu (°C): Not applicable