57609-64-0

Name TRIMETHYLENE BIS(4-AMINOBENZOATE)
CAS 57609-64-0
EINECS(EC#) 260-847-9
Molecular Formula C17H18N2O4
MDL Number MFCD00129765
Molecular Weight 314.34
MOL File 57609-64-0.mol
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Chemical Properties

Melting point  124-127 °C(lit.)
Boiling point  454.02°C (rough estimate)
density  1.14 g/mL at 140 °C (specific gravity)(lit.)
vapor pressure  9.998hPa at 21.1℃
refractive index  1.5486 (estimate)
storage temp.  2-8°C, protect from light
solubility  almost transparency in Acetone
form  powder (Granular)
pka 2.61±0.10(Predicted)
color  White to Yellow to Orange
Water Solubility  4mg/L at 25℃
InChI 1S/C17H18N2O4/c18-14-6-2-12(3-7-14)16(20)22-10-1-11-23-17(21)13-4-8-15(19)9-5-13/h2-9H,1,10-11,18-19H2
InChIKey YPACMOORZSDQDQ-UHFFFAOYSA-N
SMILES Nc1ccc(cc1)C(=O)OCCCOC(=O)c2ccc(N)cc2
LogP 2.63 at 25℃
CAS DataBase Reference 57609-64-0(CAS DataBase Reference)
EPA Substance Registry System 57609-64-0(EPA Substance)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36:Irritating to the eyes.
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
WGK Germany  3
TSCA  TSCA listed
HS Code  2922.49.3700
REACH Registrations Active
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2

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