Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate

Base Information

• Chemical Name: Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate
• CAS No.: 94086-78-9
• Molecular Formula: C17H27NO4
• Molecular Weight: 309.40058
• European Community (EC) Number: 301-868-6
• UNII: BL2CG6Q3J8
• DSSTox Substance ID: DTXSID90240397
• Nikkaji Number: J368.017G
• Wikidata: Q83123237
• Mol file: 94086-78-9.mol

Synonyms:94086-78-9;Isopropyl 4-(4-(bis(2-hydroxyethyl)amino)phenyl)butanoate;ISOPROPYL 4-[4-[N,N-BIS(2-HYDROXYETHYL)AMINO]PHENYL]BUTYRATE;EINECS 301-868-6;Isopropyl 4-(4-(N,N-bis(2-hydroxyethyl)amino)phenyl)butyrate;propan-2-yl 4-[4-[bis(2-hydroxyethyl)amino]phenyl]butanoate;BL2CG6Q3J8;DTXSID90240397;MFCD30594351;BS-52171;CS-0069661;D83883;1-Methylethyl 4-[bis(2-hydroxyethyl)amino]benzenebutanoate;4-[Bis(2-hydroxyethyl)amino]benzenebutanoic acid 1-methylethyl ester;Benzenebutanoic acid, 4-[bis(2-hydroxyethyl)amino]-, 1-methylethyl ester

Chemical Property of Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate

Chemical Property:

• Vapor Pressure: 9.04E-10mmHg at 25°C
• Refractive Index: 1.548
• Boiling Point: 473.5 °C at 760 mmHg
• PKA: 14.31±0.10(Predicted)
• Flash Point: 240.1 °C
• PSA: 70.00000
• Density: 1.126 g/cm³
• LogP: 1.75190
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 11
• Exact Mass: 309.19400834
• Heavy Atom Count: 22
• Complexity: 295

Purity/Quality:

99% ^*data from raw suppliers

Isopropyl4-(4-(bis(2-hydroxyethyl)amino)phenyl)butanoate 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)OC(=O)CCCC1=CC=C(C=C1)N(CCO)CCO