Cas no 133145-29-6 (5-(PENTYLOXY)-1H-BENZOTRIAZOLE)
133145-29-6 structure
Product Name:5-(PENTYLOXY)-1H-BENZOTRIAZOLE
CAS No:133145-29-6
MF:C11H15N3O
MW:205.256302118301
CID:899449
PubChem ID:19755975
Update Time:2025-04-19
5-(PENTYLOXY)-1H-BENZOTRIAZOLE Chemical and Physical Properties
Names and Identifiers
-
- 5-(PENTYLOXY)-1H-BENZOTRIAZOLE
- 1H-Benzotriazole, 5-(pentyloxy)-
- 5-pentoxy-2H-benzotriazole
-
- Inchi： 1S/C11H15N3O/c1-2-3-4-7-15-9-5-6-10-11(8-9)13-14-12-10/h5-6,8H,2-4,7H2,1H3,(H,12,13,14)
- InChI Key： QOLSSJHPZVQWFE-UHFFFAOYSA-N
- SMILES： O(C1C=CC2C(C=1)=NNN=2)CCCCC
Computed Properties
- Exact Mass: 204.11382
- Monoisotopic Mass: 205.121512110g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 189
- 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: 50.8?2
Experimental Properties
- Density: 1.15
- Boiling Point: 403.5°C at 760 mmHg
- Flash Point: 146.2°C
- Refractive Index: 1.586
- PSA: 47.9
5-(PENTYLOXY)-1H-BENZOTRIAZOLE Related Literature
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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