Cas no 78014-96-7 (Ethanol,2-[(2-amino-9H-purin-6-yl)oxy]-)
![Ethanol,2-[(2-amino-9H-purin-6-yl)oxy]- structure](https://ossimg.kuujia.com/scimg/78500/78014-96-7x500.png)
78014-96-7 structure
Product Name:Ethanol,2-[(2-amino-9H-purin-6-yl)oxy]-
CAS No:78014-96-7
MF:C7H9N5O2
MW:195.178660154343
CID:563787
PubChem ID:132774
Update Time:2025-04-19
Ethanol,2-[(2-amino-9H-purin-6-yl)oxy]- Chemical and Physical Properties
Names and Identifiers
-
- Ethanol,2-[(2-amino-9H-purin-6-yl)oxy]-
- 6-hydroxyethylguanine
- 78014-96-7
- (6-Hydroxyethyl)guanine
- SCHEMBL12227596
- 2-[(2-Imino-3,9-dihydro-2H-purin-6-yl)oxy]ethan-1-ol
- o6-hydroxyethylguanine
- 2-[(2-amino-7h-purin-6-yl)oxy]ethanol
- DTXSID70999275
- MFCD00800205
- Ethanol, 2-[(2-amino-9H-purin-6-yl)oxy]-
- Ethanol, 2-((2-amino-1H-purin-6-yl)oxy)-
- O(6)-Hydroxyethylguanine
-
- Inchi： 1S/C7H9N5O2/c8-7-11-5-4(9-3-10-5)6(12-7)14-2-1-13/h3,13H,1-2H2,(H3,8,9,10,11,12)
- InChI Key： BXWLIVQJPQLQDN-UHFFFAOYSA-N
- SMILES： O(CCO)C1=C2C(=NC(N)=N1)N=CN2
Computed Properties
- Exact Mass: 195.075625
- Monoisotopic Mass: 195.075625
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 193
- 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: _0.9
- Topological Polar Surface Area: 110
Experimental Properties
- Density: 1.601
- Boiling Point: 683°C at 760 mmHg
- Flash Point: 366.8°C
- Refractive Index: 1.754
Ethanol,2-[(2-amino-9H-purin-6-yl)oxy]- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
78014-96-7 (Ethanol,2-[(2-amino-9H-purin-6-yl)oxy]-) Related Products
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