[4-[bis(2-chloroethyl)amino]phenyl] 3-bromobenzoate
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![[4-[bis(2-chloroethyl)amino]phenyl] 3-bromobenzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/71958996fcf240b9a58910b122598899.png "[4-[bis(2-chloroethyl)amino]phenyl] 3-bromobenzoate")
[4-[bis(2-chloroethyl)amino]phenyl] 3-bromobenzoate
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CAS No:
22953-52-2
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Formula:
C17H16BrCl2NO2
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Chemical Name:
[4-[bis(2-chloroethyl)amino]phenyl] 3-bromobenzoate
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Synonyms:
Phenol, p-(bis(2-chloroethyl)amino)-, m-bromobenzoate;22953-52-2;BRN 2767667;p-(Bis(2-chloroethyl)amino)phenol m-bromobenzoate;p-(Bis(2-chloroethyl)amino)phenyl m-bromobenzoate;Benzoic acid, m-bromo-, p-(bis(2-chloroethyl)amino)phenyl ester;CHEMBL3246948;DTXSID10177499;ZINC95719648;p-[Bis(2-chloroethyl)amino]phenyl=m-bromobenzoate
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CAS No:
[4-[bis(2-chloroethyl)amino]phenyl] 3-bromobenzoate Basic Attributes
417.1 g/mol
414.97415 g/mol
DTXSID10177499
Computed Properties
Molecular Weight:417.1
XLogP3:5.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:8
Exact Mass:414.97415
Monoisotopic Mass:414.97415
Topological Polar Surface Area:29.5
Heavy Atom Count:23
Complexity:359
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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