Cas no 120855-11-0 (1H-Benzotriazol-7-ol,5-amino-)
1H-Benzotriazol-7-ol,5-amino- structure
Product Name:1H-Benzotriazol-7-ol,5-amino-
CAS No:120855-11-0
MF:C6H6N4O
MW:150.138040065765
CID:104871
Update Time:2024-01-24
1H-Benzotriazol-7-ol,5-amino- Chemical and Physical Properties
Names and Identifiers
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- 1H-Benzotriazol-7-ol,5-amino-
- Benzotriazol-4-ol, 6-amino- (6CI)
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- Inchi： 1S/C6H6N4O/c7-3-1-4-6(5(11)2-3)9-10-8-4/h1-2,11H,7H2,(H,8,9,10)
- InChI Key： DKXSWIJWORAKII-UHFFFAOYSA-N
- SMILES： N1C2=CC(N)=CC(O)=C2N=N1
Computed Properties
- Exact Mass: 150.054
- Monoisotopic Mass: 150.054
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 313
- 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: 79.5A^2
1H-Benzotriazol-7-ol,5-amino- Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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