3',5'-Di-O-benzoyl-2'-deoxy-2',2'-difluorocytidine

Basic Information

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CAS Number

134790-39-9

Molecular Formula

C23H19F2N3O6

Molecular Weight

471.42 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

229-232°C

Boiling Point

608.383 ℃ at 760 mmHg

SMILES

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C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)N3C=CC(=NC3=O)N)(F)F)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H19F2N3O6/c24-23(25)18(34-20(30)15-9-5-2-6-10-15)16(13-32-19(29)14-7-3-1-4-8-14)33-21(23)28-12-11-17(26)27-22(28)31/h1-12,16,18,21H,13H2,(H2,26,27,31)/t16-,18-,21-/m1/s1

InChIKey

ZPUUYUUQQGBHBU-HGHGUNKESA-N

LogP

2.440800000000001

Topological Polar Surface Area

122.73999999999998 Å²

Hydrogen Bond Donor/Acceptor

2 / 9

Complexity

852

Synonyms & References

English

ZPUUYUUQQGBHBU-HGHGUNKESA-N
(2R,3R,5R)-5-(4-Amino-2-oxopyrimidin-1(2H)-yl)-2-((benzoyloxy)methyl)-4,4-difluorotetrahydrofuran-3-ylbenzoate
DTXSID801218985
(2R,3R,5R)-5-(4-Amino-2-oxopyrimidin-1(2H)-yl)-2-((benzoyloxy)methyl)-4,4-difluorotetrahydrofuran-3-yl benzoate
3',5'-Di-O-benzoyl-2'-deoxy-2',2'-difluorocytidine
(2R,3R,5R)-5-(4-amino-2-oxopyrimidin-1(2H)-yl)-2-(benzoyloxymethyl)-4,4-difluorotetrahydrofuran-3-yl benzoate
134790-39-9
H11779
2'-Deoxy-3',5'-di-O-benzoyl-2',2'-difluorocytidine
Cytidine, 2'-deoxy-2',2'-difluoro-, 3',5'-dibenzoate
AMY38980
SCHEMBL17841790
2',2'-Difluoro-2'-deoxycytidine-3',5'-dibenzoate
[(2R,3R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-benzoyloxy-4,4-difluorooxolan-2-yl]methyl benzoate
AKOS015900585
2,2-difluoro-2-deoxycytidine-3,5-dibenzoate
2',2'-Difluoro-3',5'-dibenzoyl-2'-deoxycytidine
3',5'-Di-O-benzoyl-2',2'-difluoro-2'-deoxy cytidine
2’-Deoxy-3’,5’-di-O-benzoyl-2’,2’-difluorocytidine
Cytidine,2'-deoxy-2'2'-difluoro-,3'5'-dibenzoate (9CI)
2'-deoxy-2,2'-difluoro-3,5-dibenzyl-cytidine
Chloropurine riboside
GeMcitabine InterMediate 9
2?Deoxy-2?2?difluro-3??bis-O-benzoylcytidine
2-deoxy-2’,2’-difluoro-3’5’-bis-o-benzoyleytidine monohydrochloride
2,2-Difluoro-2-deoxycyodine-3,5-dibenzoate(or its salt)
2’,2’-Difluoro-2’-deoxycyodine-3’,5’-dibenzoate
2',2'-difluoro-2'-deoxycyldine-3',5'-dibenzoate
2',2'-Difluoro-3',5'--dibenzoyl-2'-deoxycytidine
Gemcitabine HCl Intermediate T9

MDL Number

MFCD09837611

Customs Code

2934999090

FAQ

What is 3',5'-Di-O-benzoyl-2'-deoxy-2',2'-difluorocytidine (CAS: 134790-39-9)?

3',5'-Di-O-benzoyl-2'-deoxy-2',2'-difluorocytidine (CAS: 134790-39-9) is a nucleoside derivative characterized by the presence of two benzoyl groups at the 3' and 5' positions of the ribose sugar, along with two fluorine atoms at the 2' and 2' positions. It is a white crystalline solid with a molecular formula of C16H16F2N4O6 and is known for its stability and solubility properties, making it suitable for various chemical applications.

What are the main uses of 3',5'-Di-O-benzoyl-2'-deoxy-2',2'-difluorocytidine (CAS: 134790-39-9)?

3',5'-Di-O-benzoyl-2'-deoxy-2',2'-difluorocytidine (CAS: 134790-39-9) is primarily used in pharmaceutical research as a potential antiviral agent. It also serves as a key intermediate in the synthesis of other nucleoside analogs and is applied in biochemical studies for its structural and functional properties. Its use in drug development and molecular research is supported by its chemical stability and reactivity.

Is 3',5'-Di-O-benzoyl-2'-deoxy-2',2'-difluorocytidine (CAS: 134790-39-9) safe?

3',5'-Di-O-benzoyl-2'-deoxy-2',2'-difluorocytidine (CAS: 134790-39-9) is generally considered safe when handled properly in laboratory settings. However, it should be treated with care due to its potential for chemical reactivity. Safety protocols include using appropriate personal protective equipment (PPE) and following standard chemical handling procedures to minimize exposure and ensure safe experimentation.

How should 3',5'-Di-O-benzoyl-2'-deoxy-2',2'-difluorocytidine (CAS: 134790-39-9) be stored?

3',5'-Di-O-benzoyl-2'-deoxy-2',2'-difluorocytidine (CAS: 134790-39-9) should be stored in a cool, dry, and dark place to maintain its stability. It is best kept in a sealed container at temperatures below 25°C and away from moisture and direct light. Proper storage is essential to prevent degradation and ensure its effectiveness in research and pharmaceutical applications.