5-[(6aR,10aR)-1-Hydroxy-6,6,9-trimethyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-3-yl]pentanoic acid
[CAS# 74333-70-3]

Identification

• Name: 5-[(6aR,10aR)-1-Hydroxy-6,6,9-trimethyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-3-yl]pentanoic acid
• Synonyms: (6AR-TRANS)-6A,7,8,10A-TETRAHYDRO-1-HYDROXY-6,6,9-TRIMETHYL-6H-DIBENZO[B,D]PYRAN-3-PENTANOICACID
• Molecular Formula: C₂₁H₂₈O₄
• Molecular Weight: 344.44
• CAS Registry Number: 74333-70-3
• SMILES: CC1=C[C@@H]2[C@@H](CC1)C(OC3=CC(=CC(=C23)O)CCCCC(=O)O)(C)C
• InChI: 1S/C21H28O4/c1-13-8-9-16-15(10-13)20-17(22)11-14(6-4-5-7-19(23)24)12-18(20)25-21(16,2)3/h10-12,15-16,22H,4-9H2,1-3H3,(H,23,24)/t15-,16-/m1/s1
• InChIKey: CWNRMLSJCWFXPH-HZPDHXFCSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 479.8±45.0°C at 760 mmHg (Cal.)
• Flash point: 163.6±22.2°C (Cal.)