Cas no 141762-99-4 (3H-Pyrazol-3-one,2-ethyl-1,2-dihydro-5-methyl-)
141762-99-4 structure
Product Name:3H-Pyrazol-3-one,2-ethyl-1,2-dihydro-5-methyl-
CAS No:141762-99-4
MF:C6H10N2O
MW:126.156401157379
CID:101429
PubChem ID:4739005
Update Time:2025-04-18
3H-Pyrazol-3-one,2-ethyl-1,2-dihydro-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 3H-Pyrazol-3-one,2-ethyl-1,2-dihydro-5-methyl-
- 2-ethyl-5-methyl-1H-pyrazol-3-one
- 2-Ethyl-5-methyl-1H-pyrazol-3(2H)-one
- 82439-92-7
- 1-ethyl-3-methyl-1H-pyrazol-5-ol
- 2-Ethyl-5-methyl-1,2-dihydro-3H-pyrazol-3-one
- SCHEMBL6850809
- F2198-6124
- SCHEMBL587516
- 2-ethyl-5-methyl-2H-pyrazol-3-ol
- 1-ethyl-5-hydroxy-3-methyl-1H-pyrazole
- AKOS015364166
- 3H-Pyrazol-3-one,2-ethyl-1,2-dihydro-5-methyl-(9CI)
- RFTDZPJHWZKDKG-UHFFFAOYSA-N
- 141762-99-4
-
- Inchi： 1S/C6H10N2O/c1-3-8-6(9)4-5(2)7-8/h4,7H,3H2,1-2H3
- InChI Key： KHITYTBPJJMQJQ-UHFFFAOYSA-N
- SMILES： O=C1C=C(C)NN1CC
Computed Properties
- Exact Mass: 126.079312947g/mol
- Monoisotopic Mass: 126.079312947g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 162
- 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: 0.7
- Topological Polar Surface Area: 32.3?2
3H-Pyrazol-3-one,2-ethyl-1,2-dihydro-5-methyl- Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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