Cas no 50450-73-2 (2-Benzothiazolamine,5-methoxy-N-methyl-)
50450-73-2 structure
Product Name:2-Benzothiazolamine,5-methoxy-N-methyl-
CAS No:50450-73-2
MF:C9H10N2OS
MW:194.253500461578
CID:376127
PubChem ID:148497
Update Time:2025-04-19
2-Benzothiazolamine,5-methoxy-N-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Benzothiazolamine,5-methoxy-N-methyl-
- 2-Benzothiazolamine,5-methoxy-N-methyl-(9CI)
- 2-Benzothiazolamine, 5-methoxy-N-methyl-
- DTXSID30198484
- SCHEMBL3128174
- 50450-73-2
- 5-Methoxy-N-methyl-2-benzothiazolamine
-
- Inchi： 1S/C9H10N2OS/c1-10-9-11-7-5-6(12-2)3-4-8(7)13-9/h3-5H,1-2H3,(H,10,11)
- InChI Key： LWXZUFYKLCKILN-UHFFFAOYSA-N
- SMILES： S1C(NC)=NC2C=C(C=CC1=2)OC
Computed Properties
- Exact Mass: 194.0515
- Monoisotopic Mass: 194.05138412g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 179
- 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: 2.7
- Topological Polar Surface Area: 62.4?2
Experimental Properties
- PSA: 34.15
2-Benzothiazolamine,5-methoxy-N-methyl- Related Literature
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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