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5'-Deoxy-5-fluoro-N-[(2-methylbutoxy)carbonyl]cytidine

5'-Deoxy-5-fluoro-N-[(2-methylbutoxy)carbonyl]cytidine structure

CAS No:
910129-15-6
Formula:
C15H22FN3O6
Chemical Name:
5'-Deoxy-5-fluoro-N-[(2-methylbutoxy)carbonyl]cytidine
Synonyms:
5'-Deoxy-5-fluoro-N-[(2-methylbutoxy)carbonyl]cytidine;Capecitabine iMpurity E;Cytidine, 5'-deoxy-5-fluoro-N-[(2-Methylbutoxy)carbonyl]-;5'-Deoxy-5-fluoro-N4-(2-methyl-1-butyloxycarbonyl)cytidine;Capecitabine 2-Methylbutyloxy Impurity;5'-Deoxy-5-fluoro-N4-[(2-methylbutoxy)carbonyl]-cytidine;2-Methylbutyl (1-((2R,3R,4S,5R)-3,4-dihydroxy-5-methyltetrahydrofuran-2-yl)-5-fluoro-2-oxo-1,2-dihydropyrimidin-4-yl)carbamate;Capecitabine EP Impurity D

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Description

Off-White Solid

5'-Deoxy-5-fluoro-N-[(2-methylbutoxy)carbonyl]cytidine Basic Attributes

Molecular Weight：

359.3500832

Exact Mass：

359.149261

DSSTox ID：

DTXSID20238368

HScode：

29389090

Characteristics

PSA：

121

XLogP3：

0.5

Density：

1.5±0.1 g/cm3

Melting Point：

62-64°C

Refractive Index：

1.600

Storage Conditions：

Hygroscopic, -20°C Freezer, Under Inert Atmosphere

Safety Information

Precautionary statement(s)：

P201, P202, P264, P273, P280, P281, P302+P352, P305+P351+P338, P308+P313, P321, P332+P313, P337+P313, P362, P391, P405, P501

Hazard Statements：

H315

GHS Classification：

|Danger|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P201, P202, P264, P273, P280, P281, P302+P352, P305+P351+P338, P308+P313, P321, P332+P313, P337+P313, P362, P391, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

5'-Deoxy-5-fluoro-N-[(2-methylbutoxy)carbonyl]cytidine Use and Manufacturing

A Capecitabine analog which shows antitumor activity.

Computed Properties

Molecular Weight:359.35
XLogP3:0.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:359.14926359
Monoisotopic Mass:359.14926359
Topological Polar Surface Area:121
Heavy Atom Count:25
Complexity:596
Defined Atom Stereocenter Count:4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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5-Deoxy-5-fluoro-N-[(2-methylbutoxy)carbonyl]cytidine

CAS No.: 910129-15-6

Content: 99.00%

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Guide of 5'-Deoxy-5-fluoro-N-[(2-methylbutoxy)carbonyl]cytidine

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
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5'-Deoxy-5-fluoro-N-[(2-methylbutoxy)carbonyl]cytidine

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