Cas no 22713-34-4 (1H-Benzotriazole,1-methoxy-)
1H-Benzotriazole,1-methoxy- structure
Product Name:1H-Benzotriazole,1-methoxy-
CAS No:22713-34-4
MF:C7H7N3O
MW:149.149980783463
CID:269365
PubChem ID:323685
Update Time:2025-04-19
1H-Benzotriazole,1-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Benzotriazole,1-methoxy-
- 1-methoxybenzotriazole
- 1H-1,2,3-benzotriazole, 1-methoxy-
- 1-hydroxymethylbenzotriazole
- 1-methoxy-1,2,3-benzotriazole
- 1-methoxy-1H-1,2,3-benzotriazole
- 1-Methoxy-1H-benzotriazol
- 1-methoxy-1H-benzotriazole
- 1-methoxy-benzotriazole
- AC1L895N
- C7H7N3O
- h2-5H,1H
- methoxy benzotriazole
- NSC286155
- SureCN798347
- SCHEMBL798347
- DTXSID40314577
- InChI=1/C7H7N3O/c1-11-10-7-5-3-2-4-6(7)8-9-10/h2-5H,1H
- 22713-34-4
- NSC-286155
-
- Inchi： 1S/C7H7N3O/c1-11-10-7-5-3-2-4-6(7)8-9-10/h2-5H,1H3
- InChI Key： ZHPSBMQVLQEIIC-UHFFFAOYSA-N
- SMILES： O(C)N1C2C=CC=CC=2N=N1
Computed Properties
- Exact Mass: 149.05901
- Monoisotopic Mass: 149.058911855g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 142
- 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: 1.5
- Topological Polar Surface Area: 39.9?2
Experimental Properties
- PSA: 39.94
- LogP: 0.48970
1H-Benzotriazole,1-methoxy- Related Literature
-
J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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