threo-3-Phenyl-2-butylamine methanesulfonate
[CAS# 38727-04-7]

Identification

• Name: threo-3-Phenyl-2-butylamine methanesulfonate
• Synonyms: Methanesulfonic Acid; [(1R,2S)-1-Methyl-2-Phenyl-Propyl]Amine; Dl-Threo-2-Amino-3-Phenylbutane Methanesulfonate; Dl-Threo-Alpha,Beta-Dimethylphenethylamine Monomethanesulfonate
• Molecular Formula: C₁₁H₁₉NO₃S
• Molecular Weight: 245.34
• CAS Registry Number: 38727-04-7
• SMILES: [C@H](C1=CC=CC=C1)([C@H](N)C)C.C[S](=O)(=O)O
• InChI: 1S/C10H15N.CH4O3S/c1-8(9(2)11)10-6-4-3-5-7-10;1-5(2,3)4/h3-9H,11H2,1-2H3;1H3,(H,2,3,4)/t8-,9-;/m1./s1
• InChIKey: RLICSGVROQHWKR-VTLYIQCISA-N

Properties

• Boiling point: 216.5°C at 760 mmHg (Cal.)
• Flash point: 90.6°C (Cal.)