Cas no 1750-46-5 (2-amino-5-chloro-1,3-benzoxazol-6-ol)
1750-46-5 structure
Product Name:2-amino-5-chloro-1,3-benzoxazol-6-ol
CAS No:1750-46-5
MF:C7H5ClN2O2
MW:184.579800367355
CID:906247
PubChem ID:15635
Update Time:2025-04-19
2-amino-5-chloro-1,3-benzoxazol-6-ol Chemical and Physical Properties
Names and Identifiers
-
- 2-amino-5-chloro-1,3-benzoxazol-6-ol
- 2-Amino-5-chlorobenzoxazol-6-ol
- 2-Amino-5-chlor-6-hydroxybenzoxazol
- 2-Amino-5-chlor-6-hydroxy-benzoxazol
- 2-Amino-5-chloro-6-hydroxybenzoxazole
- 2-amino-5-chloro-benzooxazol-6-ol
- 5-Chloro-2-amino-6-hydroxy-benzoxazole
- 6-Benzoxazolol, 2-amino-5-chloro-
- AC1L26B3
- BENZOXAZOLE, 2-AMINO-5-CHLORO-6-HYDROXY-
- BRN 0909558
- CTK8H2703
- NSC24956
- 2-AMino-5-chlorobenzo[d]oxazol-6-ol
- 1750-46-5
- WLN: T56 BN DOJ CZ GQ HG
- DTXSID60169920
- NSC 24956
- NSC-24956
-
- Inchi： 1S/C7H5ClN2O2/c8-3-1-4-6(2-5(3)11)12-7(9)10-4/h1-2,11H,(H2,9,10)
- InChI Key： DICNWOXTWUJPIQ-UHFFFAOYSA-N
- SMILES： ClC1C(=CC2=C(C=1)N=C(N)O2)O
Computed Properties
- Exact Mass: 184.00405
- Monoisotopic Mass: 184.004
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 181
- 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: 2.1
- Topological Polar Surface Area: 72.3A^2
Experimental Properties
- Density: 1.5431 (rough estimate)
- Boiling Point: 370.2°C at 760 mmHg
- Flash Point: 177.7°C
- Refractive Index: 1.5557 (estimate)
- PSA: 72.28
2-amino-5-chloro-1,3-benzoxazol-6-ol Related Literature
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Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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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
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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