erythro-N-(3-(Di-(2-chloroethyl)amino)-4-methylbenzoyl)-DL-phenylserine ethyl ester

Base Information

• Chemical Name: erythro-N-(3-(Di-(2-chloroethyl)amino)-4-methylbenzoyl)-DL-phenylserine ethyl ester
• CAS No.: 61454-04-4
• Molecular Formula: C23H28Cl2N2O4
• Molecular Weight: 467.3854
• DSSTox Substance ID: DTXSID40977020
• Wikidata: Q76151148

Synonyms:erythro-N-(3-(Di-(2-chloroethyl)amino)-4-methylbenzoyl)-DL-phenylserine ethyl ester;61454-04-4;DL-Phenylalanine, N-(3-(bis(2-chloroethyl)amino)-4-methylbenzoyl)-beta-hydroxy-, ethyl ester,erythro-;C23-H28-Cl2-N2-O4;C23H28Cl2N2O4;DTXSID40977020;LS-105760;3-[Bis(2-chloroethyl)amino]-N-(1-ethoxy-3-hydroxy-1-oxo-3-phenylpropan-2-yl)-4-methylbenzene-1-carboximidic acid

Chemical Property of erythro-N-(3-(Di-(2-chloroethyl)amino)-4-methylbenzoyl)-DL-phenylserine ethyl ester

Chemical Property:

• Vapor Pressure: 5.41E-18mmHg at 25°C
• Boiling Point: 653.9°Cat760mmHg
• Flash Point: 349.3°C
• Density: 1.267g/cm³
• XLogP3: 4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 12
• Exact Mass: 466.1426128
• Heavy Atom Count: 31
• Complexity: 554

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C(C(C1=CC=CC=C1)O)NC(=O)C2=CC(=C(C=C2)C)N(CCCl)CCCl
• Isomeric SMILES: CCOC(=O)[C@@H]([C@@H](C1=CC=CC=C1)O)NC(=O)C2=CC(=C(C=C2)C)N(CCCl)CCCl

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