Cas no 95121-01-0 (1H-Purin-2-ol (9CI))
1H-Purin-2-ol (9CI) structure
Product Name:1H-Purin-2-ol (9CI)
1H-Purin-2-ol (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1H-Purin-2-ol (9CI)
- 2-Purinol
- 7H-Purin-2-ol
- 51953-15-2
- Purin-2-ol
- 2H-Purin-2-one, 1,3-dihydro
- 3,9-dihydropurin-2-one
- 1h-purin-2-ol
- oxodihydropurine
- DTXSID70177652
- 2-Hydroxypurine
- Purin-2(1H)-one
- CRIZPXKICGBNKG-UHFFFAOYSA-N
- 9H-Purin-2-ol #
- AKOS006343507
- SCHEMBL276945
- 9H-Purin-2-ol(9ci)
- 2H-Purin-2-one, 1,3-dihydro-
- oxypurine
- 2-Oxopurine
- 3,7-dihydropurin-2-one
- 95121-01-0
- 2308-57-8
- 3, 7-dihydropurin-2-one
- 1,3-Dihydro-2H-purin-2-one
-
- Inchi: 1S/C5H4N4O/c10-5-6-1-3-4(9-5)8-2-7-3/h1-2H,(H2,6,7,8,9,10)
- InChI Key: CRIZPXKICGBNKG-UHFFFAOYSA-N
- SMILES: O=C1N=CC2=C(N=CN2)N1
Computed Properties
- Exact Mass: 136.039
- Monoisotopic Mass: 136.039
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 190
- 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
- Topological Polar Surface Area: 70.1A^2
- XLogP3: -0.5
Experimental Properties
- Density: 1.89
- Boiling Point: 683.3°Cat760mmHg
- Flash Point: 367.1°C
- Refractive Index: 1.902
1H-Purin-2-ol (9CI) Related Literature
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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