Cas no 344349-32-2 (3H-Purine-3-acetic acid, 6-amino-, 1,1-dimethylethyl ester)
344349-32-2 structure
Product Name:3H-Purine-3-acetic acid, 6-amino-, 1,1-dimethylethyl ester
CAS No:344349-32-2
MF:C11H15N5O2
MW:249.269101381302
CID:1464189
Update Time:2024-08-23
3H-Purine-3-acetic acid, 6-amino-, 1,1-dimethylethyl ester Chemical and Physical Properties
Names and Identifiers
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- 3H-Purine-3-acetic acid, 6-amino-, 1,1-dimethylethyl ester
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- Inchi： 1S/C11H15N5O2/c1-11(2,3)18-7(17)4-16-6-15-9(12)8-10(16)14-5-13-8/h5-6H,4,12H2,1-3H3
- InChI Key： SRCVXMGLPWYVLO-UHFFFAOYSA-N
- SMILES： N1C2C(N(CC(OC(C)(C)C)=O)C=NC=2N)=NC=1
Computed Properties
- Exact Mass: 249.12275
Experimental Properties
- Density: 1.37±0.1 g/cm3(Predicted)
- Boiling Point: 350.9±52.0 °C(Predicted)
- PSA: 92.64
- pka: 5.32±0.70(Predicted)
3H-Purine-3-acetic acid, 6-amino-, 1,1-dimethylethyl ester Related Literature
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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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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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