2-(2,4-Dihydroxy-6-methylbenzoyl)oxy-2a-hydroxy-6,6,7b-trimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta[e]indene-3-carboxylic acid

Base Information

• Chemical Name: 2-(2,4-Dihydroxy-6-methylbenzoyl)oxy-2a-hydroxy-6,6,7b-trimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta[e]indene-3-carboxylic acid
• CAS No.: 129251-06-5
• Molecular Formula: C23H28 O7
• Molecular Weight: 416.46
• Wikidata: Q110202115
• Mol file: 129251-06-5.mol

Synonyms:

Chemical Property of 2-(2,4-Dihydroxy-6-methylbenzoyl)oxy-2a-hydroxy-6,6,7b-trimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta[e]indene-3-carboxylic acid

Chemical Property:

• Vapor Pressure: 3.98E-16mmHg at 25°C
• Boiling Point: 617.9°C at 760 mmHg
• Flash Point: 213°C
• PSA: 124.29000
• Density: 1.4g/cm³
• LogP: 3.14970
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 416.18350323
• Heavy Atom Count: 30
• Complexity: 788

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1C(=O)OC2CC3(C2(C(=CC4C3CC(C4)(C)C)C(=O)O)O)C)O)O