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27410-44-2

27410-44-2 | Benzothiazole, 2-[(1-methylethyl)thio]- (9CI)

CAS No: 27410-44-2 Catalog No: AG00C54R MDL No:

Product Description

Catalog Number:
AG00C54R
Chemical Name:
Benzothiazole, 2-[(1-methylethyl)thio]- (9CI)
CAS Number:
27410-44-2
IUPAC Name:
2-propan-2-ylsulfanyl-1,3-benzothiazole
InChI:
InChI=1S/C10H11NS2/c1-7(2)12-10-11-8-5-3-4-6-9(8)13-10/h3-7H,1-2H3
InChI Key:
BCFGVQGQOPBRFC-UHFFFAOYSA-N

Properties

Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.033g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.325g/mol
Monoisotopic Mass:
209.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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