[2-(10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate
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![[2-(10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/e80aee19bb0d47acbe9f37895bdc67ff.png "[2-(10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate")
[2-(10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate
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CAS No:
22966-81-0
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Formula:
C33H43Cl2NO4
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Chemical Name:
[2-(10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate
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Synonyms:
22966-81-0;NSC109129;DTXSID20945666;Deoxycorticosterone nitrogen mustard;NSC-109129;3,20-dioxopregn-4-en-21-yl {4-[bis(2-chloroethyl)amino]phenyl}acetate
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CAS No:
[2-(10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate Basic Attributes
588.6 g/mol
587.2569142 g/mol
109129
Computed Properties
Molecular Weight:588.6
XLogP3:6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:11
Exact Mass:587.2569142
Monoisotopic Mass:587.2569142
Topological Polar Surface Area:63.7
Heavy Atom Count:40
Complexity:985
Undefined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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