4-amino-5-(2-chloroethyl)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
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![4-amino-5-(2-chloroethyl)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/3c5115583a4b4fde8f1e1a59a9569935.png "4-amino-5-(2-chloroethyl)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one")
4-amino-5-(2-chloroethyl)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
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CAS No:
90301-75-0
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Formula:
C11H16ClN3O4
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Chemical Name:
4-amino-5-(2-chloroethyl)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
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Synonyms:
5-(2-Chloroethyl)-2'-deoxycytidine;90301-75-0;UNII-502UA39973;502UA39973;CCRIS 2829;4-amino-5-(2-chloroethyl)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;DTXSID00238088;Q27896295;4-Amino-5-(2-chloroethyl)-1-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one
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CAS No:
4-amino-5-(2-chloroethyl)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one Basic Attributes
289.71 g/mol
289.0829337 g/mol
502UA39973
DTXSID00238088
Computed Properties
Molecular Weight:289.71
XLogP3:-0.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:289.0829337
Monoisotopic Mass:289.0829337
Topological Polar Surface Area:108
Heavy Atom Count:19
Complexity:426
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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