Dimethyl 5-(stearylamino)isophthalate

Base Information

• Chemical Name: Dimethyl 5-(stearylamino)isophthalate
• CAS No.: 63217-37-8
• Molecular Formula: C28H47 N O4
• Molecular Weight: 461.68
• DSSTox Substance ID: DTXSID1069794
• Nikkaji Number: J429.553F
• Wikidata: Q81996837
• Mol file: 63217-37-8.mol

Synonyms:63217-37-8;Dimethyl 5-(stearylamino)isophthalate;dimethyl 5-(octadecylamino)isophthalate;Methyl-5-N-octadecylamino-benzene 1,3 dicarbonate;Dimethyl 5-(octadecylamino)-1,3-benzenedicarboxylate;C28H47NO4;1,3-Benzenedicarboxylic acid, 5-(octadecylamino)-, dimethyl ester;1,3-Benzenedicarboxylic acid, 5-(octadecylamino)-, 1,3-dimethyl ester;dimethyl 5-(octadecylamino)benzene-1,3-dicarboxylate;DTXSID1069794;SCHEMBL11307053;dimethyl 5-octadecylaminoisophthalate;C28-H47-N-O4;AKOS024435095;FT-0717768;5-(Octadecylamino)-1,3-benzenedicarboxylic acid dimethyl ester

Chemical Property of Dimethyl 5-(stearylamino)isophthalate

Chemical Property:

• Vapor Pressure: 4.53E-13mmHg at 25°C
• Boiling Point: 571.5°C at 760 mmHg
• Flash Point: 299.4°C
• PSA: 64.63000
• Density: 0.992g/cm³
• LogP: 8.00620
• XLogP3: 10.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 22
• Exact Mass: 461.35050898
• Heavy Atom Count: 33
• Complexity: 472

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCNC1=CC(=CC(=C1)C(=O)OC)C(=O)OC