3-[(Carboxymethyl)Sulfinyl]-D-Alanine
[CAS# 125950-10-9]

Identification

• Name: 3-[(Carboxymethyl)Sulfinyl]-D-Alanine
• Synonyms: D-Alanine, 3-[(carboxymethyl)sulfinyl]-
• Molecular Formula: C₅H₉NO₅S
• Molecular Weight: 195.19
• CAS Registry Number: 125950-10-9
• SMILES: O=C(O)CS(=O)C[C@@H](N)C(O)=O
• InChI: 1S/C5H9NO5S/c6-3(5(9)10)1-12(11)2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-,12?/m1/s1
• InChIKey: DUGSIUCROZRSMS-HOTGIPKVSA-N

Properties

• Density: 1.714g/cm³ (Cal.)
• Boiling point: 582.842°C at 760 mmHg (Cal.)
• Flash point: 306.292°C (Cal.)
• Refractive index: 1.633 (Cal.)