diethyl-[2-[[(E)-3-phenylprop-2-enoyl]-(pyridin-1-ium-4-ylmethyl)amino]ethyl]azanium,dichloride
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diethyl-[2-[[(E)-3-phenylprop-2-enoyl]-(pyridin-1-ium-4-ylmethyl)amino]ethyl]azanium,dichloride
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CAS No:
100908-65-4
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Formula:
C21H29Cl2N3O
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Chemical Name:
diethyl-[2-[[(E)-3-phenylprop-2-enoyl]-(pyridin-1-ium-4-ylmethyl)amino]ethyl]azanium,dichloride
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CAS No:
diethyl-[2-[[(E)-3-phenylprop-2-enoyl]-(pyridin-1-ium-4-ylmethyl)amino]ethyl]azanium,dichloride Basic Attributes
410.38000
409.1687679
Computed Properties
Molecular Weight:410.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:409.1687679
Monoisotopic Mass:409.1687679
Topological Polar Surface Area:38.9
Heavy Atom Count:27
Complexity:394
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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