Cas no 72093-28-8 (1H-Purin-2,8-t2-6-amine(9CI))
1H-Purin-2,8-t2-6-amine(9CI) structure
Product Name:1H-Purin-2,8-t2-6-amine(9CI)
CAS No:72093-28-8
MF:C5H5N5
MW:139.142917871475
CID:548938
PubChem ID:136238512
Update Time:2025-04-19
1H-Purin-2,8-t2-6-amine(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1H-Purin-2,8-t2-6-amine(9CI)
- ADENINE, [2,8-3H]
- [3H]-Adenine
- < 2,8-3H> adenine
- 7(9)H-[2,8-3H]purin-6-ylamine
- Adenin-2,8-T
- Adenine-2,8-3H
- Adenine,[2,8-3H]
- 72093-28-8
-
- Inchi： 1S/C5H5N5/c6-4-3-5(9-1-7-3)10-2-8-4/h1-2H,(H3,6,7,8,9,10)/i1T,2T
- InChI Key： GFFGJBXGBJISGV-RVQWGROCSA-N
- SMILES： N1C([3H])=NC2=C(N)N=C([3H])N=C12
Computed Properties
- Exact Mass: 139.07094368g/mol
- Monoisotopic Mass: 139.07094368g/mol
- Isotope Atom Count: 2
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 127
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.2
- Topological Polar Surface Area: 80.5?2
1H-Purin-2,8-t2-6-amine(9CI) Security Information
- Hazardous Material transportation number：UN 2910 7
- WGK Germany：-
- Safety Instruction： 18
-
Hazardous Material Identification：
- Storage Condition：2-8°C
1H-Purin-2,8-t2-6-amine(9CI) Related Literature
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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