3-Chloropropanoic Acid 6-Methylheptyl Ester
[CAS# 57807-80-4]

Identification

• Name: 3-Chloropropanoic Acid 6-Methylheptyl Ester
• Synonyms: 3-Chloropropanoic Acid 6-Methylheptyl Ester; 3-Chloropropionic Acid 6-Methylheptyl Ester; Propanoic Acid, 3-Chloro-, Isooctyl Ester
• Molecular Formula: C₁₁H₂₁ClO₂
• Molecular Weight: 220.74
• CAS Registry Number: 57807-80-4
• SMILES: C(C(=O)OCCCCCC(C)C)CCl
• InChI: 1S/C11H21ClO2/c1-10(2)6-4-3-5-9-14-11(13)7-8-12/h10H,3-9H2,1-2H3
• InChIKey: KKDGZGXVTXSTLK-UHFFFAOYSA-N

Properties

• Density: 0.98g/cm³ (Cal.)
• Boiling point: 269.044°C at 760 mmHg (Cal.)
• Flash point: 116.967°C (Cal.)