Cas no 50663-54-2 (9H-Purin-2-amine,6-(2-propen-1-yloxy)-)
50663-54-2 structure
Product Name:9H-Purin-2-amine,6-(2-propen-1-yloxy)-
CAS No:50663-54-2
MF:C8H9N5O
MW:191.189960241318
CID:385272
PubChem ID:179571
Update Time:2025-04-19
9H-Purin-2-amine,6-(2-propen-1-yloxy)- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Purin-2-amine,6-(2-propen-1-yloxy)-
- 6-prop-2-enoxy-7H-purin-2-amine
- 6-(prop-2-en-1-yloxy)-7H-purin-2-amine
- 6-allyloxy-7(9)H-purin-2-ylamine
- 6-Allyloxy-9H-purin-2-ylamine
- 6-O-allylguanine
- AC1L45IB
- CHEBI:288485
- CHEMBL325053
- DNC004022
- O6-(2-Propenyl)guanin
- O6-(allyl)guanine
- O6-Allyl-guanin
- O6-allylguanine
- O6-Substituted Guanine Deriv. 15
- SureCN1263549
- 2-Amino-6-(allyloxy)purine
- BDBM5475
- 50663-54-2
- SCHEMBL1263549
- PD182820
- 6-[(Prop-2-en-1-yl)oxy]-3,9-dihydro-2H-purin-2-imine
- DTXSID90964900
- 6-(prop-2-en-1-yloxy)-9H-purin-2-amine
- NU 2028
-
- Inchi： 1S/C8H9N5O/c1-2-3-14-7-5-6(11-4-10-5)12-8(9)13-7/h2,4H,1,3H2,(H3,9,10,11,12,13)
- InChI Key： HJMGFQNIHIHSCQ-UHFFFAOYSA-N
- SMILES： O(CC=C)C1C2=C(N=C(N)N=1)N=CN2
Computed Properties
- Exact Mass: 191.08087
- Monoisotopic Mass: 191.08070993g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 212
- 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: 0.4
- Topological Polar Surface Area: 89.7?2
Experimental Properties
- Density: 1.52±0.1 g/cm3 (20 oC 760 Torr),
- Solubility: Slightly soluble (9.6 g/l) (25 o C),
- PSA: 89.71
9H-Purin-2-amine,6-(2-propen-1-yloxy)- Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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