C6524

Cholesteryl hexanoate

• Synonym(s): 3β-Hydroxy-5-cholestene 3-hexanoate, 5-Cholesten-3β-ol 3-hexanoate, Cholesteryl caproate
• Empirical Formula (Hill Notation): C₃₃H₅₆O₂
• CAS Number: 1062-96-0
• Molecular Weight: 484.80
• EC Number: 213-899-1
• MDL number: MFCD00037707
• UNSPSC Code: 12352108
• PubChem Substance ID: 24892875

Properties

• storage temp.: −20°C
• SMILES string: CCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CC=C2C1)[C@H](C)CCCC(C)C
• InChI: 1S/C33H56O2/c1-7-8-9-13-31(34)35-26-18-20-32(5)25(22-26)14-15-27-29-17-16-28(24(4)12-10-11-23(2)3)33(29,6)21-19-30(27)32/h14,23-24,26-30H,7-13,15-22H2,1-6H3/t24-,26+,27+,28-,29+,30+,32+,33-/m1/s1
• InChI key: FPBODWXATDKICU-FLFWOSPYSA-N

Safety Information

• Storage Class Code: 13 - Non Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves