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(2S,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolane-3-carbonitrile

(2S,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolane-3-carbonitrile structure

CAS No:
121055-70-7
Formula:
C10H12N4O4
Chemical Name:
(2S,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolane-3-carbonitrile
Synonyms:
Cytidine,3'-cyano-3'-deoxy; 3'-C-Cyano-3'-deoxycytidine; CNddC;

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(2S,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolane-3-carbonitrile Basic Attributes

Molecular Weight：

252.22700

Exact Mass：

252.08585488 g/mol

DSSTox ID：

DTXSID10153132

Characteristics

PSA：

135.38000

XLogP3：

-1.44172

Density：

1.75g/cm3

Boiling Point：

596.9ºC

Flash Point：

314.8ºC

Refractive Index：

1.743

Vapor Pressure：

9.77E-17mmHg at 25°C

Computed Properties

Molecular Weight:252.23
XLogP3:-1.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:252.08585488
Monoisotopic Mass:252.08585488
Topological Polar Surface Area:132
Heavy Atom Count:18
Complexity:466
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: tricalcium phosphate; magnesium metal plus silver acetate; formula sulphur dioxide; hydrofluoric acid formula; dichlorine monoxide; hexane sds

Guide of (2S,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)oxolane-3-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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