Cyclopenta(4,5)cyclooct(1,2-f)indene-6-carboxaldehyde, 1,2,3,3a,4,6a,7,7a,8,9,10,10a,11,11a-tetradecahydro-10-(1-methylethyl)-3,7a,12-trimethyl-2-(beta-D-xylopyranosyloxy)-, (2S-(2-alpha,3-beta,3a-beta,6a-alpha,7a-alpha,10-beta,10a-beta,11a-beta))-

Base Information

• Chemical Name: Cyclopenta(4,5)cyclooct(1,2-f)indene-6-carboxaldehyde, 1,2,3,3a,4,6a,7,7a,8,9,10,10a,11,11a-tetradecahydro-10-(1-methylethyl)-3,7a,12-trimethyl-2-(beta-D-xylopyranosyloxy)-, (2S-(2-alpha,3-beta,3a-beta,6a-alpha,7a-alpha,10-beta,10a-beta,11a-beta))-
• CAS No.: 122535-46-0
• Molecular Formula: C30H46 O6
• Molecular Weight: 532.713
• Wikidata: Q104666891
• Mol file: 122535-46-0.mol

Synonyms:aleurodiscal

Chemical Property of Cyclopenta(4,5)cyclooct(1,2-f)indene-6-carboxaldehyde, 1,2,3,3a,4,6a,7,7a,8,9,10,10a,11,11a-tetradecahydro-10-(1-methylethyl)-3,7a,12-trimethyl-2-(beta-D-xylopyranosyloxy)-, (2S-(2-alpha,3-beta,3a-beta,6a-alpha,7a-alpha,10-beta,10a-beta,11a-beta))-

Chemical Property:

• Vapor Pressure: 3.23E-19mmHg at 25°C
• Boiling Point: 642.5°Cat760mmHg
• Flash Point: 204°C
• PSA: 96.22000
• Density: 1.19g/cm³
• LogP: 4.02680
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 502.32943918
• Heavy Atom Count: 36
• Complexity: 909

Purity/Quality:

95%+ ^*data from raw suppliers

ALEURODISCAL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C2CC=C(C3CC4(CCC(C4CC3C(=C2CC1OC5C(C(C(CO5)O)O)O)C)C(C)C)C)C=O
• Isomeric SMILES: C[C@H]1[C@@H]/2C/C=C(\[C@H]3C[C@]4(CC[C@H]([C@@H]4C[C@@H]3/C(=C2/C[C@@H]1O[C@H]5[C@@H]([C@H]([C@@H](CO5)O)O)O)/C)C(C)C)C)/C=O