Home Halogens 2-Benzothiazolamine,7-chloro-4-methoxy-(9CI)

2-Benzothiazolamine,7-chloro-4-methoxy-(9CI)

CAS No.:
67618-12-6
Catalog Number:
AG00FJPH
Molecular Formula:
C8H7ClN2OS
Molecular Weight:
214.6720
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Product Description
Catalog Number:
AG00FJPH
Chemical Name:
2-Benzothiazolamine,7-chloro-4-methoxy-(9CI)
CAS Number:
67618-12-6
Molecular Formula:
C8H7ClN2OS
Molecular Weight:
214.6720
IUPAC Name:
7-chloro-4-methoxy-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C8H7ClN2OS/c1-12-5-3-2-4(9)7-6(5)11-8(10)13-7/h2-3H,1H3,(H2,10,11)
InChI Key:
CLFYPDRIWLKZOS-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1nc(s2)N)Cl
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.997g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.667g/mol
Monoisotopic Mass:
213.997g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
76.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties