2-[[Bis(2-chloroethyl)amino]methyl]-5-nitrophenylalanine
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![2-[[Bis(2-chloroethyl)amino]methyl]-5-nitrophenylalanine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/838a1af0a8264fd1a1ae8e33200e3370.png "2-[[Bis(2-chloroethyl)amino]methyl]-5-nitrophenylalanine")
2-[[Bis(2-chloroethyl)amino]methyl]-5-nitrophenylalanine
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CAS No:
54940-95-3
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Formula:
C14H19Cl2N3O4
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Chemical Name:
2-[[Bis(2-chloroethyl)amino]methyl]-5-nitrophenylalanine
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Synonyms:
Phenylalanine,2-[[bis(2-chloroethyl)amino]methyl]-5-nitro-;2-[[Bis(2-chloroethyl)amino]methyl]-5-nitrophenylalanine;AT 1258;Nitrocaphane;NSC 245413;75023-24-4
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CAS No:
Computed Properties
Molecular Weight:364.2
XLogP3:-0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:363.0752615
Monoisotopic Mass:363.0752615
Topological Polar Surface Area:112
Heavy Atom Count:23
Complexity:389
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-[[Bis(2-chloroethyl)amino]methyl]-5-nitrophenylalanine
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