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5-[5-Hydroxy-4-(3-hydroxy-4-methyl-1-octen-6-yn-1-yl)hexahydro-2(1H)-pentalenylidene]pentanoic acid
[CAS# 85026-51-3]

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Identification
Name 5-[5-Hydroxy-4-(3-hydroxy-4-methyl-1-octen-6-yn-1-yl)hexahydro-2(1H)-pentalenylidene]pentanoic acid
Molecular Structure CAS#: 85026-51-3, 5-[5-Hydroxy-4-(3-hydroxy-4-methyl-1-octen-6-yn-1-yl)hexahydro-2(1H)-pentalenylidene]pentanoic acid
Molecular Formula C22H32O4
Molecular Weight 360.49
CAS Registry Number 85026-51-3
SMILES OC2CC1CC(CC1C2C=CC(O)C(C)CC#CC)=CCCCC(O)=O
InChI 1S/C22H32O4/c1-3-4-7-15(2)20(23)11-10-18-19-13-16(8-5-6-9-22(25)26)12-17(19)14-21(18)24/h8,10-11,15,17-21,23-24H,5-7,9,12-14H2,1-2H3,(H,25,26)
InChIKey HIFJCPQKFCZDDL-UHFFFAOYSA-N
Properties
Density 1.211g/cm3 (Cal.)
Boiling point 539.239°C at 760 mmHg (Cal.)
Flash point 293.99°C (Cal.)
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