(13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate
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![(13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/5f39f4defe1046febbfe4da0ad87c386.png "(13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate")
(13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate
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CAS No:
22964-49-4
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Formula:
C30H35Cl2NO3
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Chemical Name:
(13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate
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Synonyms:
22964-49-4;NSC109712;DTXSID50945659;NSC-109712;17-Oxoestra-1(10),2,4-trien-3-yl {4-[bis(2-chloroethyl)amino]phenyl}acetate
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CAS No:
(13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate Basic Attributes
528.5 g/mol
527.1993994 g/mol
109712
Computed Properties
Molecular Weight:528.5
XLogP3:6.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:527.1993994
Monoisotopic Mass:527.1993994
Topological Polar Surface Area:46.6
Heavy Atom Count:36
Complexity:778
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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