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10205-69-3

10205-69-3 | Benzothiazole, 6-methoxy-2-phenyl-

CAS No: 10205-69-3 Catalog No: AG0006GA MDL No:

Product Description

Catalog Number:
AG0006GA
Chemical Name:
Benzothiazole, 6-methoxy-2-phenyl-
CAS Number:
10205-69-3
Molecular Formula:
C14H11NOS
Molecular Weight:
241.3082
IUPAC Name:
6-methoxy-2-phenyl-1,3-benzothiazole
InChI:
InChI=1S/C14H11NOS/c1-16-11-7-8-12-13(9-11)17-14(15-12)10-5-3-2-4-6-10/h2-9H,1H3
InChI Key:
RHWASMBUKSNCDV-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)sc(n2)c1ccccc1

Properties

Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.056g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.308g/mol
Monoisotopic Mass:
241.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  

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