C2400

5α-Cholanic acid-3α-ol-6-one 3-acetate methyl ester

~97%

• Sinónimos: 3α-Hydroxy-6-oxo-5α-cholan-24-oic acid methyl ester 3-acetate, Methyl 3α-acetoxy-6-oxo-5α-cholanate
• Fórmula empírica (notación de Hill): C₂₇H₄₂O₅
• Número CAS: 2616-79-7
• Peso molecular: 446.62
• NACRES: NA.77
• PubChem Substance ID: 24892325
• UNSPSC Code: 12352200
• MDL number: MFCD00056455

Propiedades

• assay: ~97%
• form: solid
• SMILES string: [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC(=O)[C@@]4([H])C[C@@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(C)=O)[C@H](C)CCC(=O)OC
• InChI: 1S/C27H42O5/c1-16(6-9-25(30)31-5)20-7-8-21-19-15-24(29)23-14-18(32-17(2)28)10-12-27(23,4)22(19)11-13-26(20,21)3/h16,18-23H,6-15H2,1-5H3/t16-,18-,19+,20-,21+,22+,23-,26-,27-/m1/s1
• InChI key: KCGQCQPWFSUPDS-SFESAZTESA-N

Descripción

Información de seguridad

• Clase de almacenamiento: 11 - Combustible Solids
• wgk: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: Eyeshields, Gloves, type N95 (US)