Dap-tmb

Base Information

• Chemical Name: Dap-tmb
• CAS No.: 102358-22-5
• Molecular Formula: C31H34 N2 O8
• Molecular Weight: 562.61026
• Mol file: 102358-22-5.mol

Synonyms:DAP-TMB;deacetylpicraline 3,4,5-trimethoxybenzoate

Chemical Property of Dap-tmb

Chemical Property:

• Vapor Pressure: 1.51E-17mmHg at 25°C
• Boiling Point: 664.9°Cat760mmHg
• Flash Point: 355.9°C
• PSA: 104.79000
• Density: 1.39g/cm³
• LogP: 3.57470
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 9
• Exact Mass: 562.23151605
• Heavy Atom Count: 41
• Complexity: 1100

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=C1CN2C3CC1C(C45C3(NC6=CC=CC=C64)OC2C5)(COC(=O)C7=CC(=C(C(=C7)OC)OC)OC)C(=O)OC
• Isomeric SMILES: C/C=C\1/CN2[C@H]3C[C@@H]1C([C@@]45[C@@]3(NC6=CC=CC=C64)O[C@H]2C5)(COC(=O)C7=CC(=C(C(=C7)OC)OC)OC)C(=O)OC

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