Benzyl butyl adipate

Base Information

• Chemical Name: Benzyl butyl adipate
• CAS No.: 4121-13-5
• Molecular Formula: C17H24 O4
• Molecular Weight: 292.37006
• Hs Code.: 2917120090
• European Community (EC) Number: 223-915-9
• DSSTox Substance ID: DTXSID00194130
• Nikkaji Number: J224.927H
• Wikidata: Q81977248
• Mol file: 4121-13-5.mol

Synonyms:Benzyl butyl adipate;Adimoll BB;Butyl benzyladipinate;ADIPIC ACID, BENZYL BUTYL ESTER;4121-13-5;EINECS 223-915-9;BRN 1996660;Hexanedioic acid, butyl phenylmethyl ester;benzylbutyladipat;SCHEMBL659043;DTXSID00194130;Adipic acid 1-butyl 6-phenylmethyl ester

Chemical Property of Benzyl butyl adipate

Chemical Property:

• Vapor Pressure: 6.54E-06mmHg at 25°C
• Boiling Point: 377.9°Cat760mmHg
• Flash Point: 180°C
• PSA: 52.60000
• Density: 1.052g/cm³
• LogP: 3.63350
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 12
• Exact Mass: 292.16745924
• Heavy Atom Count: 21
• Complexity: 295

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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