7-Hydroxy-1beta,4aalpha-Dimethyl-8-Methylenegibbane-1alpha,10beta-Dicarboxylic Acid
[CAS# 51576-08-0]

Identification

• Name: 7-Hydroxy-1beta,4aalpha-Dimethyl-8-Methylenegibbane-1alpha,10beta-Dicarboxylic Acid
• Synonyms: Lmpr01040067; (1S,2S,3S,4R,8S,9S,12S)-12-Hydroxy-4,8-Dimethyl-13-Methylidenetetracyclo[10.2.1.0(1,9).0(3,8)]Pentadecane-2,4-Dicarboxylic Acid; 7Alpha-Hydroxy-1Beta,4A-Dimethyl-8-Methylidene-4Aalpha,4Bbeta-Gibbane-1Alpha,10Beta-Dicarboxylic Acid
• Molecular Formula: C₂₀H₂₈O₅
• Molecular Weight: 348.44
• CAS Registry Number: 51576-08-0
• SMILES: [C@@]234[C@H]([C@@H]1[C@](C(=O)O)(CCC[C@]1([C@@H]2CC[C@@](C3)(O)C(C4)=C)C)C)C(=O)O
• InChI: 1S/C20H28O5/c1-11-9-19-10-20(11,25)8-5-12(19)17(2)6-4-7-18(3,16(23)24)14(17)13(19)15(21)22/h12-14,25H,1,4-10H2,2-3H3,(H,21,22)(H,23,24)/t12-,13+,14-,17-,18+,19-,20-/m0/s1
• InChIKey: CZEMYYICWZPENF-VOLTXKGXSA-N

Properties

• Density: 1.305g/cm³ (Cal.)
• Boiling point: 513.743°C at 760 mmHg (Cal.)
• Flash point: 278.588°C (Cal.)