Benzyl octyl adipate

Base Information

• Chemical Name: Benzyl octyl adipate
• CAS No.: 3089-55-2
• Molecular Formula: C21H32 O4
• Molecular Weight: 348.4764
• Hs Code.: 2917120090
• European Community (EC) Number: 221-431-2
• UNII: MR5CLK3Y44
• DSSTox Substance ID: DTXSID20184896
• Nikkaji Number: J217.264J
• Wikidata: Q27284187
• Mol file: 3089-55-2.mol

Synonyms:Benzyl octyl adipate;3089-55-2;Hexanedioic acid, octyl phenylmethyl ester;6-O-benzyl 1-O-octyl hexanedioate;UNII-MR5CLK3Y44;MR5CLK3Y44;C21H32O4;Hexanedioic acid, 1-octyl 6-(phenylmethyl) ester;EINECS 221-431-2;benzyloctyladipat;benzyloctyladipate;ADIMOLL BO;SCHEMBL772826;Adipic acid, benzyl octyl ester;DTXSID20184896;MFCD00048940;AKOS015995024;Adipic acid 1-octyl 6-phenylmethyl ester;DS-18487;1-O-octyl 6-O-(phenylmethyl) hexanedioate;AM20040141;CS-0152151;FT-0688403;S10637;Q27284187

Chemical Property of Benzyl octyl adipate

Chemical Property:

• Vapor Pressure: 9.62E-08mmHg at 25°C
• Boiling Point: 434.2°Cat760mmHg
• Flash Point: 206.5°C
• PSA: 52.60000
• Density: 1.013g/cm³
• LogP: 5.19390
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 16
• Exact Mass: 348.23005950
• Heavy Atom Count: 25
• Complexity: 348

Purity/Quality:

99% ^*data from raw suppliers

BenzylOctylAdipate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCOC(=O)CCCCC(=O)OCC1=CC=CC=C1