5,6-Epoxy-beta,beta-Carotene
[CAS# 1923-89-3]

Identification

• Name: 5,6-Epoxy-beta,beta-Carotene
• Synonyms: 2,2,6-Trimethyl-1-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-Tetramethyl-18-(2,6,6-Trimethyl-1-Cyclohexenyl)Octadeca-1,3,5,7,9,11,13,15,17-Nonaenyl]-7-Oxabicyclo[4.1.0]Heptane; Lmpr01070267; 5,6-Epoxy-Beta,Beta-Carotene
• Molecular Formula: C₄₀H₅₆O
• Molecular Weight: 552.88
• CAS Registry Number: 1923-89-3
• SMILES: CC13C(O1)(/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(CCCC2(C)C)C)C)C)C)C)C(CCC3)(C)C
• InChI: 1S/C40H56O/c1-31(19-13-21-33(3)24-25-36-35(5)23-15-27-37(36,6)7)17-11-12-18-32(2)20-14-22-34(4)26-30-40-38(8,9)28-16-29-39(40,10)41-40/h11-14,17-22,24-26,30H,15-16,23,27-29H2,1-10H3/b12-11+,19-13+,20-14+,25-24+,30-26+,31-17+,32-18+,33-21+,34-22+
• InChIKey: RVCRIPILOFSMFG-WWSVUWEKSA-N

Properties

• Density: 0.987g/cm³ (Cal.)
• Boiling point: 649.637°C at 760 mmHg (Cal.)
• Flash point: 317.394°C (Cal.)