Chemical Property of (E)-4-[4-[bis(2-chloroethyl)amino]phenyl]but-3-enoic acid
Chemical Property:
- Vapor Pressure:2E-10mmHg at 25°C
- Boiling Point:490.2°C at 760 mmHg
- PKA:4.11±0.10(Predicted)
- Flash Point:250.3°C
- PSA：40.54000
- Density:1.284g/cm3
- LogP:3.45850
- XLogP3:3.3
- Hydrogen Bond Donor Count:1
- Hydrogen Bond Acceptor Count:3
- Rotatable Bond Count:8
- Exact Mass:301.0636342
- Heavy Atom Count:19
- Complexity:283
- Purity/Quality:
-
99% *data from raw suppliers
(E)-4-[4-[Bis(2-chloroethyl)amino]phenyl]-3-butenoicAcid *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
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SDS file from LookChem
Useful:
- Canonical SMILES:C1=CC(=CC=C1C=CCC(=O)O)N(CCCl)CCCl
- Isomeric SMILES:C1=CC(=CC=C1/C=C/CC(=O)O)N(CCCl)CCCl
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Uses
(E)-4-[4-[Bis(2-chloroethyl)amino]phenyl]-3-butenoic Acid is a metabolite of Chlorambucil (C325050), a chemotherapy drug that has been mainly used in the treatment of chronic lymphocytic leukemia.
