Diethylene glycol abietate
[CAS# 10107-99-0]

Identification

• Name: Diethylene glycol abietate
• Synonyms: 2-(2-Hydroxyethoxy)Ethyl (1R,4Ar,4Br,10Ar)-7-Isopropyl-1,4A-Dimethyl-2,3,4,4B,5,6,10,10A-Octahydrophenanthrene-1-Carboxylate; (1R,4Ar,4Br,10Ar)-7-Isopropyl-1,4A-Dimethyl-2,3,4,4B,5,6,10,10A-Octahydrophenanthrene-1-Carboxylic Acid 2-(2-Hydroxyethoxy)Ethyl Ester; 1-Phenanthrenecarboxylic Acid, 1,2,3,4,4A,4B,5,6,10,10A-Decahydro-1,4A-Dimethyl-7-(1-Methylethyl)-, 2-(2-Hydroxyethoxy)Ethyl Ester, (1R,4Ar,4Br,10Ar)-
• Molecular Formula: C₂₄H₃₈O₄
• Molecular Weight: 390.56
• CAS Registry Number: 10107-99-0
• SMILES: [C@H]13[C@@]([C@@H]2C(=CC1)C=C(CC2)C(C)C)(CCC[C@]3(C(OCCOCCO)=O)C)C
• InChI: 1S/C24H38O4/c1-17(2)18-6-8-20-19(16-18)7-9-21-23(20,3)10-5-11-24(21,4)22(26)28-15-14-27-13-12-25/h7,16-17,20-21,25H,5-6,8-15H2,1-4H3/t20-,21+,23+,24+/m0/s1
• InChIKey: PXVVQEJCUSSVKQ-XWVZOOPGSA-N

Properties

• Density: 1.081g/cm³ (Cal.)
• Boiling point: 512.792°C at 760 mmHg (Cal.)
• Flash point: 166.67°C (Cal.)