Cas no 90399-86-3 (4H-Pyrazolo[3,4-d]pyrimidin-4-one,1,5-dihydro-6-methyl-5-phenyl-)
![4H-Pyrazolo[3,4-d]pyrimidin-4-one,1,5-dihydro-6-methyl-5-phenyl- structure](https://ossimg.kuujia.com/scimg/90500/90399-86-3x500.png)
90399-86-3 structure
Product Name:4H-Pyrazolo[3,4-d]pyrimidin-4-one,1,5-dihydro-6-methyl-5-phenyl-
CAS No:90399-86-3
MF:C12H10N4O
MW:226.234001636505
CID:816003
PubChem ID:337065
Update Time:2025-04-19
4H-Pyrazolo[3,4-d]pyrimidin-4-one,1,5-dihydro-6-methyl-5-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 4H-Pyrazolo[3,4-d]pyrimidin-4-one,1,5-dihydro-6-methyl-5-phenyl-
- NSC-353694
- NSC353694
- 90399-86-3
- DTXSID20320010
-
- Inchi： 1S/C12H10N4O/c1-8-14-11-10(7-13-15-11)12(17)16(8)9-5-3-2-4-6-9/h2-7H,1H3,(H,13,15)
- InChI Key： ZLJKWMTVLCGUEC-UHFFFAOYSA-N
- SMILES： O=C1C2C=NNC=2N=C(C)N1C1C=CC=CC=1
Computed Properties
- Exact Mass: 226.085
- Monoisotopic Mass: 226.085
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 348
- 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: 1.1
- Topological Polar Surface Area: 61.4?2
Experimental Properties
- Density: 1.39
- Boiling Point: 474°Cat760mmHg
- Flash Point: 240.5°C
- Refractive Index: 1.722
4H-Pyrazolo[3,4-d]pyrimidin-4-one,1,5-dihydro-6-methyl-5-phenyl- 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
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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