2-[(1-Cyclohexyl-1H-Tetrazol-5-Yl)Thio]-Propanoic Acid
[CAS# 433253-83-9]

Identification

• Name: 2-[(1-Cyclohexyl-1H-Tetrazol-5-Yl)Thio]-Propanoic Acid
• Synonyms: (2S)-2-[(1-Cyclohexyl-5-Tetrazolyl)Thio]Propanoate; (2S)-2-[(1-Cyclohexyltetrazol-5-Yl)Thio]Propionate; (2S)-2-[(1-Cyclohexyl-1,2,3,4-Tetrazol-5-Yl)Sulfanyl]Propanoate
• Molecular Formula: C₁₀H₁₅N₄O₂S
• Molecular Weight: 255.31
• CAS Registry Number: 433253-83-9
• SMILES: [C@@H](SC1=NN=N[N]1C2CCCCC2)(C([O-])=O)C
• InChI: 1S/C10H16N4O2S/c1-7(9(15)16)17-10-11-12-13-14(10)8-5-3-2-4-6-8/h7-8H,2-6H2,1H3,(H,15,16)/p-1/t7-/m0/s1
• InChIKey: ZUJQHSWZNUSBNZ-ZETCQYMHSA-M

Properties

• Boiling point: 462.568°C at 760 mmHg (Cal.)
• Flash point: 233.553°C (Cal.)