Cas no 146950-63-2 (Pyrido[3,4-b]pyrazine-2,3-dione,1,4-dihydro-4-methyl-)
![Pyrido[3,4-b]pyrazine-2,3-dione,1,4-dihydro-4-methyl- structure](https://ossimg.kuujia.com/scimg/147000/146950-63-2x500.png)
146950-63-2 structure
Product Name:Pyrido[3,4-b]pyrazine-2,3-dione,1,4-dihydro-4-methyl-
CAS No:146950-63-2
MF:C8H7N3O2
MW:177.160081148148
CID:100956
PubChem ID:19102550
Update Time:2025-04-18
Pyrido[3,4-b]pyrazine-2,3-dione,1,4-dihydro-4-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Pyrido[3,4-b]pyrazine-2,3-dione,1,4-dihydro-4-methyl-
- 4-METHYL-1,4-DIHYDROPYRIDO[3,4-B]PYRAZINE-2,3-DIONE
- 4-methyl-1H-pyrido[3,4-b]pyrazine-2,3-dione
- 4-PHENYLURAZOLE
- Pyrido[3,4-b]pyrazine-2,3-dione, 1,4-dihydro-4-methyl- (9CI)
- DTXSID90598103
- SCHEMBL9432790
- 146950-63-2
- 4-Methylpyrido[3,4-b]pyrazine-2,3(1H,4H)-dione
-
- Inchi： 1S/C8H7N3O2/c1-11-6-4-9-3-2-5(6)10-7(12)8(11)13/h2-4H,1H3,(H,10,12)
- InChI Key： FUXUPTRORCDGQZ-UHFFFAOYSA-N
- SMILES： O=C1C(NC2C=CN=CC=2N1C)=O
Computed Properties
- Exact Mass: 177.05391
- Monoisotopic Mass: 177.053826475g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 254
- 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
- Surface Charge: 0
- Tautomer Count: 3
- XLogP3: -0.4
- Topological Polar Surface Area: 62.3?2
Experimental Properties
- PSA: 62.3
Pyrido[3,4-b]pyrazine-2,3-dione,1,4-dihydro-4-methyl- Related Literature
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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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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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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