1-(4-(bis(2-chloroethyl)amino)benzyl)-4-(ethoxycarbonyl)pyridin-1-ium 4-methylbenzenesulfonate
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1-(4-(bis(2-chloroethyl)amino)benzyl)-4-(ethoxycarbonyl)pyridin-1-ium 4-methylbenzenesulfonate
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CAS No:
7237-85-6
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Formula:
C26H30Cl2N2O5S
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Chemical Name:
1-(4-(bis(2-chloroethyl)amino)benzyl)-4-(ethoxycarbonyl)pyridin-1-ium 4-methylbenzenesulfonate
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CAS No:
1-(4-(bis(2-chloroethyl)amino)benzyl)-4-(ethoxycarbonyl)pyridin-1-ium 4-methylbenzenesulfonate Basic Attributes
553.49800
552.1252486
94550
Computed Properties
Molecular Weight:553.5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:552.1252486
Monoisotopic Mass:552.1252486
Topological Polar Surface Area:99
Heavy Atom Count:36
Complexity:569
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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