3-(3,5-Dimethoxybenzoyl)veracevine

Base Information

• Chemical Name: 3-(3,5-Dimethoxybenzoyl)veracevine
• CAS No.: 136060-11-2
• Molecular Formula: C36H51NO11
• Molecular Weight: 673.7902
• DSSTox Substance ID: DTXSID80929245
• Mol file: 136060-11-2.mol

Synonyms:3-(3,5-Dimethoxybenzoyl)veracevine;Veracevine, 3-(3,5-dimethoxybenzoate)-;136060-11-2;Cevane-3,4,12,14,16,17,20-heptol, 4,9-epoxy-, 3-(3,5-dimethoxybenzoate), (3-beta,4-alpha,16-beta)-;DTXSID80929245;LS-52851;4,12,14,16,17,20-Hexahydroxy-4,9-epoxycevan-3-yl 3,5-dimethoxybenzoate

Chemical Property of 3-(3,5-Dimethoxybenzoyl)veracevine

Chemical Property:

• Vapor Pressure: 1.58E-28mmHg at 25°C
• Boiling Point: 821°Cat760mmHg
• Flash Point: 450.3°C
• Density: 1.45g/cm³
• XLogP3: 1
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 5
• Exact Mass: 673.34621144
• Heavy Atom Count: 48
• Complexity: 1320

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC2C(C3(C(CC4(C5CCC6C7(C5(CC4(C3CN2C1)O)OC6(C(CC7)OC(=O)C8=CC(=CC(=C8)OC)OC)O)C)O)O)O)(C)O
• Isomeric SMILES: C[C@H]1CC[C@H]2[C@@](C3([C@H](CC4([C@@H]5CCC6[C@]7(C5(CC4([C@@H]3CN2C1)O)O[C@@]6([C@H](CC7)OC(=O)C8=CC(=CC(=C8)OC)OC)O)C)O)O)O)(C)O

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