Sitophilate
[CAS# 114607-20-4]

Identification

• Name: Sitophilate
• Synonyms: 1-Ethylpropyl (2S,3R)-3-Hydroxy-2-Methyl-Pentanoate; (2S,3R)-3-Hydroxy-2-Methylpentanoic Acid 1-Ethylpropyl Ester; (2S,3R)-3-Hydroxy-2-Methyl-Valeric Acid 1-Ethylpropyl Ester
• Molecular Formula: C₁₁H₂₂O₃
• Molecular Weight: 202.29
• CAS Registry Number: 114607-20-4
• SMILES: [C@@H](C(OC(CC)CC)=O)([C@H](O)CC)C
• InChI: 1S/C11H22O3/c1-5-9(6-2)14-11(13)8(4)10(12)7-3/h8-10,12H,5-7H2,1-4H3/t8-,10+/m0/s1
• InChIKey: JZOCRUBSQNZLIW-WCBMZHEXSA-N

Properties

• Density: 0.953g/cm³ (Cal.)
• Boiling point: 283.443°C at 760 mmHg (Cal.)
• Flash point: 108.557°C (Cal.)