3-[2-[Bis(2-chloroethyl)amino]phenyl]prop-2-enoic acid
3-[2-[bis(2-chloroethyl)amino]phenyl]prop-2-enoic acid
Also Known As: O-N,N-Bis(2-chloroethyl)aminocinnamic acid|ortho-N,N-Bis(2-chloroethyl)aminocinnamic acid|3-(2-(Bis(2-chloroethyl)amino)phenyl)-2-propenoic acid|3-[2-[bis(2-chloroethyl)amino]phenyl]prop-2-enoic acid|2-Propenoic acid, 3-(2-(bis(2-chloroethyl)amino)phenyl)-|2-Propenoic acid, 3-[2-[bis(2-chloroethyl)amino]phenyl]|(Z)-3-[2-[bis(2-chloroethyl)amino]phenyl]prop-2-enoic acid
| Molecular Formula | C13H15Cl2NO2 |
|---|---|
| Molecular Weight | 287.04797 g/mol |
| LogP | 3.07 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 287.04797 |
| Heavy Atoms | 18 |
| Complexity | 415.2 |
Chemical Identifiers
| CAS Number | 64976-97-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=CC(=O)O)N(CCCl)CCCl |
Product Overview
3-[2-[Bis(2-chloroethyl)amino]phenyl]prop-2-enoic acid (CAS 64976-97-2), with molecular formula C13H15Cl2NO2 and molecular weight 287.04797 g/mol. IUPAC: 3-[2-[bis(2-chloroethyl)amino]phenyl]prop-2-enoic acid.
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