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383142-27-6

383142-27-6 | Benzothiazole, 2-(1H-pyrrol-1-yl)- (9CI)

CAS No: 383142-27-6 Catalog No: AG00CPET MDL No:

Product Description

Catalog Number:
AG00CPET
Chemical Name:
Benzothiazole, 2-(1H-pyrrol-1-yl)- (9CI)
CAS Number:
383142-27-6
IUPAC Name:
2-pyrrol-1-yl-1,3-benzothiazole
InChI:
InChI=1S/C11H8N2S/c1-2-6-10-9(5-1)12-11(14-10)13-7-3-4-8-13/h1-8H
InChI Key:
XXHJABOPNDFQDQ-UHFFFAOYSA-N

Properties

Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.041g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.259g/mol
Monoisotopic Mass:
200.041g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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