3987-53-9

Name N-BENZYLIMINODIACETIC ACID
CAS 3987-53-9
EINECS(EC#) 223-631-5
Molecular Formula C11H13NO4
MDL Number MFCD00004285
Molecular Weight 223.23
MOL File 3987-53-9.mol
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Chemical Properties

Melting point  200-202 °C (dec.)(lit.)
Boiling point  420.9±35.0 °C(Predicted)
density  1.326±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
Water Solubility  very faint turbidity in hot Water
form  powder to crystal
pka 1.77±0.10(Predicted)
color  White to Almost white
InChI 1S/C11H13NO4/c13-10(14)7-12(8-11(15)16)6-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,13,14)(H,15,16)
InChIKey SZQUPQVVCLFZLC-UHFFFAOYSA-N
SMILES OC(=O)CN(CC(O)=O)Cc1ccccc1
CAS DataBase Reference 3987-53-9(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Risk Statements 
Safety Statements 
WGK Germany  3
HS Code  2922.49.8000
REACH Registrations Active
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

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