N-cyclohexylcyclohexanamine;(2S)-3-(1H-indol-3-yl)-2-[(2-nitrophenyl)sulfanylamino]propanoic acid
[CAS# 7675-55-0]

Identification

• Name: N-cyclohexylcyclohexanamine;(2S)-3-(1H-indol-3-yl)-2-[(2-nitrophenyl)sulfanylamino]propanoic acid
• Synonyms: N-(2-Nitrophenylsulfenyl)-L-tryptophan (dicyclohexylammonium) salt; N-O-NITROPHENYLSULFENYL-L-TRYPTOPHANDI AMMONIUMSALT
• Molecular Formula: C₂₉H₃₈N₄O₄S
• Molecular Weight: 538.70
• CAS Registry Number: 7675-55-0
• SMILES: [O-][N+](=O)c3ccccc3SN[C@H](C(=O)O)Cc2c1ccccc1nc2.N(C1CCCCC1)C2CCCCC2
• InChI: 1S/C17H15N3O4S.C12H23N/c21-17(22)14(9-11-10-18-13-6-2-1-5-12(11)13)19-25-16-8-4-3-7-15(16)20(23)24;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-8,10,14,18-19H,9H2,(H,21,22);11-13H,1-10H2/t14-;/m0./s1
• InChIKey: QLCIBFSGUWUCDS-UQKRIMTDSA-N

Properties

• Boiling point: 745.1°C at 760 mmHg (Cal.)
• Flash point: 404.4°C (Cal.)