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166450-64-2

166450-64-2 | Benzothiazole, 2-(1-methoxyethyl)-

CAS No: 166450-64-2 Catalog No: AG001WQS MDL No:

Product Description

Catalog Number:
AG001WQS
Chemical Name:
Benzothiazole, 2-(1-methoxyethyl)-
CAS Number:
166450-64-2
Molecular Formula:
C10H11NOS
Molecular Weight:
193.2654
IUPAC Name:
2-(1-methoxyethyl)-1,3-benzothiazole
InChI:
InChI=1S/C10H11NOS/c1-7(12-2)10-11-8-5-3-4-6-9(8)13-10/h3-7H,1-2H3
InChI Key:
MABGDBXSOISORR-UHFFFAOYSA-N
SMILES:
COC(c1nc2c(s1)cccc2)C

Properties

Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.056g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.264g/mol
Monoisotopic Mass:
193.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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