ChemicalBook--->CAS DataBase List--->362-42-5

362-42-5

362-42-5 Structure

362-42-5 Structure
IdentificationBack Directory
[Name]

2',3'-O-isopropylidene cytidine
[CAS]

362-42-5
[Synonyms]

Molnupiravir Impurity 9
2',3'-isopropylidenecytidine
O2',O3'-isopropylidene-cytidine
2',3'-O-isopropylidene cytidine
2',3'-O-(1-Methylethylidene)cytidine
β-D-2',3'-O-(isopropylidene)cytidine
Cytidine, 2',3'-O-(1-methylethylidene)-
4-amino-1-[2,3-O-(1-methylethylidene)pentofuranosyl]pyrimidi...
4-amino-1-[2,3-O-(1-methylethylidene)pentofuranosyl]pyrimidin-2(1H)-one
4-amino-1-[6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]pyrimidin-2-one
[Molecular Formula]

C12H17N3O5
[MDL Number]

MFCD15145298
[MOL File]

362-42-5.mol
[Molecular Weight]

283.28
Chemical PropertiesBack Directory
[Melting point ]

238-240℃ (methanol )
[Boiling point ]

465.7±55.0 °C(Predicted)
[density ]

1.66±0.1 g/cm3 (20℃ 760 Torr)
[form ]

Solid
[pka]

14.14±0.10(Predicted)
[color ]

White
[InChI]

InChI=1S/C12H17N3O5/c1-12(2)19-8-6(5-16)18-10(9(8)20-12)15-4-3-7(13)14-11(15)17/h3-4,6,8-10,16H,5H2,1-2H3,(H2,13,14,17)/t6-,8-,9-,10-/m1/s1
[InChIKey]

UBGDNZQSYVIVHU-PEBGCTIMSA-N
[SMILES]

OC[C@H]1O[C@@H](N2C=CC(N)=NC2=O)[C@@H]2OC(O[C@H]12)(C)C
Hazard InformationBack Directory
[Uses]

2'',3''-Isopropylidenecytidine is an intermediate in synthesizing 5-Hydroxymethylcytidine-13CD2 (H947092), an analogue of 5-Hydroxymethylcytidine (H947090) which is a product in DNA hydroxymethylation.
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