Hexanedioic acid - 1,3-butanediol (1:1)
[CAS 86438-03-1]

Identification

• Name: Hexanedioic acid - 1,3-butanediol (1:1)
• Molecular Formula: C₁₀H₂₀O₆
• Molecular Weight: 236.26
• CAS Registry Number: 86438-03-1
• SMILES: O=C(O)CCCCC(=O)O.OCCC(O)C
• InChI: 1S/C6H10O4.C4H10O2/c7-5(8)3-1-2-4-6(9)10;1-4(6)2-3-5/h1-4H2,(H,7,8)(H,9,10);4-6H,2-3H2,1H3
• InChIKey: KKPMZLPPEXRJOM-UHFFFAOYSA-N

Properties

• Boiling point: 338.5°C at 760 mmHg (Cal.)
• Flash point: 172.7°C (Cal.)