1-(2-chloroethyl)-3-[[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]phenyl]methyl]-1-nitrosourea
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![1-(2-chloroethyl)-3-[[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]phenyl]methyl]-1-nitrosourea structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6fee5d0e1b294b51819a7d7054dff58e.png "1-(2-chloroethyl)-3-[[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]phenyl]methyl]-1-nitrosourea")
1-(2-chloroethyl)-3-[[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]phenyl]methyl]-1-nitrosourea
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CAS No:
54340-56-6
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Formula:
C20H22Cl2N6O4
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Chemical Name:
1-(2-chloroethyl)-3-[[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]phenyl]methyl]-1-nitrosourea
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Synonyms:
54340-56-6;Urea, 1,1'-(4,4'-biphenylylenedimethylene)bis(3-(2-chloroethyl)-3-nitroso-;NSC 116821;NSC116821;1,1'-(4,4'-Biphenylylenedimethylene)bis(3-(2-chloroethyl)-3-nitrosourea);DTXSID70202716;ZINC5004863;NSC-116821;Urea,N''-[[1,1'-biphenyl]-4,4'-diylbis(methylene)]bis[N'-(2-chloroethyl)-N'-nitroso-;Urea, N,N''-((1,1'-biphenyl)-4,4'-diylbis(methylene))bis(N'-(2-chloroethyl)-N'-nitroso- (9CI)
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CAS No:
1-(2-chloroethyl)-3-[[4-[4-[[[2-chloroethyl(nitroso)carbamoyl]amino]methyl]phenyl]phenyl]methyl]-1-nitrosourea Basic Attributes
481.3 g/mol
480.1079586 g/mol
116821
DTXSID70202716
Computed Properties
Molecular Weight:481.3
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:480.1079586
Monoisotopic Mass:480.1079586
Topological Polar Surface Area:124
Heavy Atom Count:32
Complexity:561
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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