Cas no 65370-91-4 (6-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1h-1,3,5-triazine-2,4-dione)
65370-91-4 structure
Product Name:6-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1h-1,3,5-triazine-2,4-dione
CAS No:65370-91-4
MF:C8H12N4O6
MW:260.204081535339
CID:961825
PubChem ID:320524
Update Time:2025-04-19
6-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1h-1,3,5-triazine-2,4-dione Chemical and Physical Properties
Names and Identifiers
-
- 6-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1h-1,3,5-triazine-2,4-dione
- 6-oxo-5-azacytidine
- AC1L82E5
- NSC268496
- SureCN6671219
- 65370-91-4
- DTXSID90313292
- NSC-268496
- SCHEMBL6671219
-
- Inchi: 1S/C8H12N4O6/c9-6-10-7(16)12(8(17)11-6)5-4(15)3(14)2(1-13)18-5/h2-5,13-15H,1H2,(H3,9,10,11,16,17)
- InChI Key: BOWVQIZEPQZYLW-UHFFFAOYSA-N
- SMILES: O1C(CO)C(C(C1N1C(N=C(N)NC1=O)=O)O)O
Computed Properties
- Exact Mass: 260.07576
- Monoisotopic Mass: 260.07568412g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 412
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -2.8
- Topological Polar Surface Area: 158?2
Experimental Properties
- PSA: 157.71
- LogP: -2.88120
6-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1h-1,3,5-triazine-2,4-dione Related Literature
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
-
Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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