2-Phenylbutyl 2-(dimethylamino)-3,4,5-trimethoxybenzoate

Base Information

• Chemical Name: 2-Phenylbutyl 2-(dimethylamino)-3,4,5-trimethoxybenzoate
• CAS No.: 58997-88-9
• Molecular Formula: C22H29 N O5
• Molecular Weight: 387.46936
• European Community (EC) Number: 261-546-5
• DSSTox Substance ID: DTXSID30974482
• Mol file: 58997-88-9.mol

Synonyms:2-phenylbutyl 2-(dimethylamino)-3,4,5-trimethoxybenzoate;58997-88-9;EINECS 261-546-5;EINECS 261-547-0;EINECS 261-548-6;UNII-9RKX7S7WFY;UNII-U4UUZ24TRB;DTXSID30974482;2-(dimethylamino)-2-phenylbutyl (+-)-3,4,5-trimethoxybenzoate;2-(Dimethylamino)-2-phenylbutyl (+)-3,4,5-trimethoxybenzoate

Chemical Property of 2-Phenylbutyl 2-(dimethylamino)-3,4,5-trimethoxybenzoate

Chemical Property:

• Vapor Pressure: 3.11E-10mmHg at 25°C
• Boiling Point: 502.7°C at 760 mmHg
• Flash Point: 257.8°C
• PSA: 57.23000
• Density: 1.112g/cm³
• LogP: 4.12900
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 10
• Exact Mass: 387.20457303
• Heavy Atom Count: 28
• Complexity: 466

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(COC(=O)C1=CC(=C(C(=C1N(C)C)OC)OC)OC)C2=CC=CC=C2