(3R,4S,5R)-4-Amino-5-(Hydroxymethyl)-3-Methoxy-1-Cyclohexene-1-Carboxylic Acid
[CAS# 169139-95-1]

Identification

• Name: (3R,4S,5R)-4-Amino-5-(Hydroxymethyl)-3-Methoxy-1-Cyclohexene-1-Carboxylic Acid
• Synonyms: (3R,4S,5R)-4-amino-5-(hydroxymethyl)-3-methoxycyclohex-1-enecarboxylic acid
• Molecular Formula: C₉H₁₅NO₄
• Molecular Weight: 201.22
• CAS Registry Number: 169139-95-1
• SMILES: O=C(O)/C1=C/[C@@H](OC)[C@@H](N)[C@H](CO)C1
• InChI: 1S/C9H15NO4/c1-14-7-3-5(9(12)13)2-6(4-11)8(7)10/h3,6-8,11H,2,4,10H2,1H3,(H,12,13)/t6-,7+,8-/m0/s1
• InChIKey: KFAZROUISGZBTI-RNJXMRFFSA-N

Properties

• Density: 1.288g/cm³ (Cal.)
• Boiling point: 381.043°C at 760 mmHg (Cal.)
• Flash point: 184.248°C (Cal.)
• Refractive index: 1.551 (Cal.)