Cas no 33216-89-6 (2(1H)-Pyrazinone,5-ethyl-3,6-dimethyl-)
33216-89-6 structure
Product Name:2(1H)-Pyrazinone,5-ethyl-3,6-dimethyl-
CAS No:33216-89-6
MF:C8H12N2O
MW:152.193681716919
CID:294110
PubChem ID:15768472
Update Time:2025-04-19
2(1H)-Pyrazinone,5-ethyl-3,6-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2(1H)-Pyrazinone,5-ethyl-3,6-dimethyl-
- 5-ethyl-3,6-dimethyl-1H-pyrazin-2-one
- 3,6-Dimethyl-5-ethyl-2(1H)-pyrazinone
- Pyrazinol,5-ethyl-3,6-dimethyl- (8CI)
- RSYGJEQPLQQHBH-UHFFFAOYSA-N
- 33216-89-6
- DTXSID30578146
- 2(1H)-Pyrazinone,5-ethyl-3,6-dimethyl-(9CI)
- 5-Ethyl-3,6-dimethylpyrazin-2(1H)-one
-
- Inchi： 1S/C8H12N2O/c1-4-7-5(2)10-8(11)6(3)9-7/h4H2,1-3H3,(H,10,11)
- InChI Key： RSYGJEQPLQQHBH-UHFFFAOYSA-N
- SMILES： O=C1C(C)=NC(CC)=C(C)N1
Computed Properties
- Exact Mass: 152.09506
- Monoisotopic Mass: 152.094963011g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 251
- 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: 0.5
- Topological Polar Surface Area: 41.5?2
Experimental Properties
- PSA: 41.46
2(1H)-Pyrazinone,5-ethyl-3,6-dimethyl- Related Literature
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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