5-(3,5-Di-Sec-Butylcyclopent-1-Enyl)-2,3,5-Trihydroxyvaleric Acid
[CAS# 491-14-5]

Identification

• Name: 5-(3,5-Di-Sec-Butylcyclopent-1-Enyl)-2,3,5-Trihydroxyvaleric Acid
• Synonyms: 5-(3,5-Disec-Butyl-1-Cyclopentenyl)-2,3,5-Trihydroxy-Pentanoic Acid; 5-(3,5-Disec-Butyl-1-Cyclopentenyl)-2,3,5-Trihydroxypentanoic Acid; 5-(3,5-Disec-Butyl-1-Cyclopentenyl)-2,3,5-Trihydroxy-Valeric Acid
• Molecular Formula: C₁₈H₃₂O₅
• Molecular Weight: 328.45
• CAS Registry Number: 491-14-5
• EINECS: 207-731-6
• SMILES: C(C(O)C1=CC(CC1C(CC)C)C(CC)C)C(O)C(O)C(=O)O
• InChI: 1S/C18H32O5/c1-5-10(3)12-7-13(11(4)6-2)14(8-12)15(19)9-16(20)17(21)18(22)23/h8,10-13,15-17,19-21H,5-7,9H2,1-4H3,(H,22,23)
• InChIKey: RKOUCPMGBBKLNK-UHFFFAOYSA-N

Properties

• Density: 1.132g/cm³ (Cal.)
• Boiling point: 528.859°C at 760 mmHg (Cal.)
• Flash point: 287.72°C (Cal.)