Chemical Properties of Deoxycytidine (CAS 951-77-9)

InChI

InChI=1S/C9H13N3O4/c10-7-1-2-12(9(15)11-7)8-3-5(14)6(4-13)16-8/h1-2,5-6,8,13-14H,3-4H2,(H2,10,11,15)

InChI Key

CKTSBUTUHBMZGZ-UHFFFAOYSA-N

Formula

C9H13N3O4

SMILES

Nc1ccn(C2CC(O)C(CO)O2)c(=O)n1

Molecular Weight¹

227.22

CAS

951-77-9

Other Names

• 2'-Deoxycytidine
• 2(1H)-Pyrimidinone, 4-amino-1-(2-deoxy-«beta»-D-erythro-pentofuranosyl)-
• Cytidine, 2'-deoxy-
• Cytosine deoxyribonucleoside
• Cytosine deoxyriboside
• Cytosine, 1-(2-deoxy-«beta»-D-erythro-pentofuranosyl)-
• Deoxyribose cytidine
• Desoxycytidine
• dCYD

• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• EA : Electron affinity (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to Deoxycytidine.

Mixtures

• Formamide, N,N-dimethyl- + Deoxycytidine + Water
• Deoxycytidine + Water

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Homotactic enthalpic pairwise interactions of four deoxynucleosides (dU, dC, dG, dT) in dimethylformamide (DMF) + water mixtures at 298.15 K
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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