Cas no 81265-89-6 (2H-Indazole,2-(3-methoxyphenyl)-)
81265-89-6 structure
Product Name:2H-Indazole,2-(3-methoxyphenyl)-
CAS No:81265-89-6
MF:C14H12N2O
MW:224.257883071899
CID:727697
PubChem ID:3067342
Update Time:2025-04-19
2H-Indazole,2-(3-methoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2H-Indazole,2-(3-methoxyphenyl)-
- 2-(3-Methoxyphenyl)-2H-indazole
- 2-(3-methoxyphenyl)indazole
- 2H-Indazole, 2-(3-methoxyphenyl)-
- 81265-89-6
- DTXSID10231025
- M.G. 18843
-
- Inchi: 1S/C14H12N2O/c1-17-13-7-4-6-12(9-13)16-10-11-5-2-3-8-14(11)15-16/h2-10H,1H3
- InChI Key: JNQANLFHMOCZAS-UHFFFAOYSA-N
- SMILES: O(C)C1=CC=CC(=C1)N1C=C2C=CC=CC2=N1
Computed Properties
- Exact Mass: 224.094963
- Monoisotopic Mass: 224.094963
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 259
- 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: 27
- XLogP3: 3.2
Experimental Properties
- Density: 1.15
- Boiling Point: 283.2°C at 760 mmHg
- Flash Point: 125.1°C
- Refractive Index: 1.615
2H-Indazole,2-(3-methoxyphenyl)- Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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