Cas no 343773-68-2 (Ethanone,1-(3,7-dimethyl-1H-indazol-1-yl)-)
343773-68-2 structure
Product Name:Ethanone,1-(3,7-dimethyl-1H-indazol-1-yl)-
CAS No:343773-68-2
MF:C11H12N2O
MW:188.225782394409
CID:302362
PubChem ID:12639178
Update Time:2025-04-19
Ethanone,1-(3,7-dimethyl-1H-indazol-1-yl)- Chemical and Physical Properties
Names and Identifiers
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- Ethanone,1-(3,7-dimethyl-1H-indazol-1-yl)-
- 1H-Indazole,1-acetyl-3,7-dimethyl- (9CI)
- 343773-68-2
- 1-(3,7-dimethyl-1H-indazol-1-yl)ethan-1-one
- 1-(3,7-Dimethyl-1H-indazol-1-yl)ethanone
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- Inchi: 1S/C11H12N2O/c1-7-5-4-6-10-8(2)12-13(9(3)14)11(7)10/h4-6H,1-3H3
- InChI Key: RUGHLGFVONZXQT-UHFFFAOYSA-N
- SMILES: O=C(C)N1C2C(C)=CC=CC=2C(C)=N1
Computed Properties
- Exact Mass: 188.09506
- Monoisotopic Mass: 188.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 241
- 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
- Topological Polar Surface Area: 34.9A^2
- XLogP3: 2.2
Experimental Properties
- PSA: 34.89
Ethanone,1-(3,7-dimethyl-1H-indazol-1-yl)- Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Jason Wan Lab Chip, 2020,20, 4528-4538
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