Cas no 117309-81-6 (5'-Cytidylicacid, 5-ethyl-, diammonium salt (9CI))
117309-81-6 structure
Product Name:5'-Cytidylicacid, 5-ethyl-, diammonium salt (9CI)
CAS No:117309-81-6
MF:C11H18N3O8P
MW:351.249683856964
CID:234586
PubChem ID:512626
Update Time:2025-04-19
5'-Cytidylicacid, 5-ethyl-, diammonium salt (9CI) Chemical and Physical Properties
Names and Identifiers
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- 5'-Cytidylicacid, 5-ethyl-, diammonium salt (9CI)
- 5-Ethylcytidine 5'-monophosphate
- DTXSID80922392
- 117309-81-6
- 5-Ethyl-4-imino-1-(5-O-phosphonopentofuranosyl)-1,4-dihydropyrimidin-2-ol
- [(2R,3S,4R,5R)-5-(4-amino-5-ethyl-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
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- Inchi： 1S/C11H18N3O8P/c1-2-5-3-14(11(17)13-9(5)12)10-8(16)7(15)6(22-10)4-21-23(18,19)20/h3,6-8,10,15-16H,2,4H2,1H3,(H2,12,13,17)(H2,18,19,20)/t6-,7-,8-,10-/m1/s1
- InChI Key： SKGFOLAMDDXPCJ-FDDDBJFASA-N
- SMILES： P(=O)(O)(O)OC[C@@H]1[C@H]([C@H]([C@H](N2C(N=C(C(CC)=C2)N)=O)O1)O)O
Computed Properties
- Exact Mass: 351.08324
- Monoisotopic Mass: 351.083151
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 23
- Rotatable Bond Count: 5
- Complexity: 588
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: _3.2
- Topological Polar Surface Area: 175
Experimental Properties
- Density: 1.93
- Boiling Point: 663.8°Cat760mmHg
- Flash Point: 355.3°C
- Refractive Index: 1.72
- PSA: 175.14
5'-Cytidylicacid, 5-ethyl-, diammonium salt (9CI) Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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3. Estimation of hydrogen sulfide from crude petroleum: a unique invention using a simple chemosensor?Shampa Kundu,Prithidipa Sahoo New J. Chem., 2019,43, 12369-12374
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
117309-81-6 (5'-Cytidylicacid, 5-ethyl-, diammonium salt (9CI)) Related Products
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