Chlorohyssopifolin B
[CAS# 38290-03-8]

Identification

• Name: Chlorohyssopifolin B
• Synonyms: (3Ar,4S,6Ar,8S,9S,9As,9Bs)-9-(Chloromethyl)-4,8,9-Trihydroxy-3,6-Dimethylene-3A,4,5,6A,7,8,9A,9B-Octahydroazuleno[5,4-D]Furan-2-One; Azuleno(4,5-B)Furan-2(3H)-One, Decahydro-3,6-Bis(Methylene)-9-(Chloromethyl)-4,8,9-Trihydroxy-, (3Ar-(3A-Alpha,4-Alpha,6A-Alpha,8-Beta,9-Alpha,9A-Alpha,9B-Beta))-; Chlorohyssopifolin B
• Molecular Formula: C₁₅H₁₉ClO₅
• Molecular Weight: 314.77
• CAS Registry Number: 38290-03-8
• SMILES: [C@@H]23[C@@H]1[C@H](C(=C)C(O1)=O)[C@@H](O)CC([C@@H]2C[C@@H]([C@]3(O)CCl)O)=C
• InChI: 1S/C15H19ClO5/c1-6-3-9(17)11-7(2)14(19)21-13(11)12-8(6)4-10(18)15(12,20)5-16/h8-13,17-18,20H,1-5H2/t8-,9-,10-,11+,12-,13-,15+/m0/s1
• InChIKey: YIFQICREHIVCKL-YWDFAVMRSA-N

Properties

• Density: 1.424g/cm³ (Cal.)
• Boiling point: 544.137°C at 760 mmHg (Cal.)
• Flash point: 282.884°C (Cal.)