Cas no 55866-24-5 (1,2,3-Butanetriol, 2-methyl-4-(1H-purin-6-ylamino)-)
55866-24-5 structure
Product Name:1,2,3-Butanetriol, 2-methyl-4-(1H-purin-6-ylamino)-
CAS No:55866-24-5
MF:C10H15N5O3
MW:253.257801294327
CID:350418
PubChem ID:53803908
Update Time:2025-04-19
1,2,3-Butanetriol, 2-methyl-4-(1H-purin-6-ylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 1,2,3-Butanetriol, 2-methyl-4-(1H-purin-6-ylamino)-
- 2-methyl-4-(7H-purin-6-ylamino)butane-1,2,3-triol
- 2-Methyl-4-[(7H-purin-6-yl)amino]butane-1,2,3-triol
- 55866-24-5
- DTXSID30706785
- 6-(2,3,4-trihydroxy-3-methylbutylamino) purine
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- Inchi： 1S/C10H15N5O3/c1-10(18,3-16)6(17)2-11-8-7-9(13-4-12-7)15-5-14-8/h4-6,16-18H,2-3H2,1H3,(H2,11,12,13,14,15)
- InChI Key： FKHYWNLUSRZJFP-UHFFFAOYSA-N
- SMILES： OC(C)(CO)C(CNC1=C2C(=NC=N1)N=CN2)O
Computed Properties
- Exact Mass: 253.11765
- Monoisotopic Mass: 253.11748936g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 282
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.8
- Topological Polar Surface Area: 127?2
Experimental Properties
- PSA: 121.83
1,2,3-Butanetriol, 2-methyl-4-(1H-purin-6-ylamino)- Related Literature
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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5. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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