Cas no 709038-33-5 (Benzothiazole,2-(butoxymethyl)-)
709038-33-5 structure
Product Name:Benzothiazole,2-(butoxymethyl)-
CAS No:709038-33-5
MF:C12H15NOS
MW:221.318601846695
CID:557792
PubChem ID:71440035
Update Time:2025-04-19
Benzothiazole,2-(butoxymethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzothiazole,2-(butoxymethyl)-
- Benzothiazole, 2-(butoxymethyl)- (5CI)
- 709038-33-5
- 2-(Butoxymethyl)-1,3-benzothiazole
-
- Inchi： 1S/C12H15NOS/c1-2-3-8-14-9-12-13-10-6-4-5-7-11(10)15-12/h4-7H,2-3,8-9H2,1H3
- InChI Key： HPHMUJALPCDUFL-UHFFFAOYSA-N
- SMILES： S1C2C=CC=CC=2N=C1COCCCC
Computed Properties
- Exact Mass: 221.087
- Monoisotopic Mass: 221.087
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- 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
- Topological Polar Surface Area: 50.4A^2
- XLogP3: 3.3
Benzothiazole,2-(butoxymethyl)- Related Literature
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1. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
709038-33-5 (Benzothiazole,2-(butoxymethyl)-) Related Products
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