Cas no 110967-34-5 (1H-Indazole,3-ethyl-5-methyl-)
1H-Indazole,3-ethyl-5-methyl- structure
Product Name:1H-Indazole,3-ethyl-5-methyl-
CAS No:110967-34-5
MF:C10H12N2
MW:160.215682029724
CID:129042
PubChem ID:13706103
Update Time:2025-04-18
1H-Indazole,3-ethyl-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indazole,3-ethyl-5-methyl-
- 3-ethyl-5-methyl-2H-indazole
- 3-ETHYL-5-METHYL-1H-INDAZOLE
- AGN-PC-00NNA6
- CTK8G5661
- INDAZOLE, 3-ETHYL-5-METHYL-
- MB69231
- SureCN7352631
- SCHEMBL7352631
- 110967-34-5
- 1H-Indazole, 3-ethyl-5-methyl-
-
- Inchi： 1S/C10H12N2/c1-3-9-8-6-7(2)4-5-10(8)12-11-9/h4-6H,3H2,1-2H3,(H,11,12)
- InChI Key： URVJQVBRGZLRNH-UHFFFAOYSA-N
- SMILES： N1C(CC)=C2C=C(C)C=CC2=N1
Computed Properties
- Exact Mass: 159.09233
- Monoisotopic Mass: 160.100048391g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 158
- 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: 2.8
- Topological Polar Surface Area: 28.7?2
Experimental Properties
- PSA: 25.78
- LogP: 2.43370
1H-Indazole,3-ethyl-5-methyl- Related Literature
-
Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
-
S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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