Ethyl N-({4-[bis(2-chloroethyl)amino]phenyl}acetyl)-L-methioninate
[CAS# 3819-34-9]

Identification

• Name: Ethyl N-({4-[bis(2-chloroethyl)amino]phenyl}acetyl)-L-methioninate
• Synonyms: ethyl N-({4-[bis(2-chloroethyl)amino]phenyl}acetyl)-L-methioninate; L-methionine, N-[2-[4-[bis(2-chloroethyl)amino]phenyl]acetyl]-, ethyl ester; Phenamet
• Molecular Formula: C₁₉H₂₈Cl₂N₂O₃S
• Molecular Weight: 435.41
• CAS Registry Number: 3819-34-9
• SMILES: CCOC(=O)[C@H](CCSC)NC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl
• InChI: 1S/C19H28Cl2N2O3S/c1-3-26-19(25)17(8-13-27-2)22-18(24)14-15-4-6-16(7-5-15)23(11-9-20)12-10-21/h4-7,17H,3,8-14H2,1-2H3,(H,22,24)/t17-/m0/s1
• InChIKey: QSRLNKCNOLVZIR-KRWDZBQOSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 619.3±55.0°C at 760 mmHg (Cal.)
• Flash point: 328.3±31.5°C (Cal.)