![Phenethyl 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate structure](/static/products/7706/77063-16-2.webp)
Phenethyl 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate
2-phenylethyl 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate
Also Known As: phenethyl 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate|2-phenylethyl 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate|2-Phenylethyl 4-{4-[bis(2-chloroethyl)amino]phenyl}butanoate
CAS: 77063-16-2
| Molecular Formula | C22H27Cl2NO2 |
|---|---|
| Molecular Weight | 407.14188 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 407.14188 |
| Monoisotopic Mass | 407.14188 |
| Heavy Atoms | 27 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 77063-16-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCOC(=O)CCCC2=CC=C(C=C2)N(CCCl)CCCl |
| InChIKey | KOUAMUDOBHPDIP-UHFFFAOYSA-N |
Product Overview
Phenethyl 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate (CAS 77063-16-2), with molecular formula C22H27Cl2NO2 and molecular weight 407.14188 g/mol. IUPAC: 2-phenylethyl 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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