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72889-30-6

72889-30-6 | Benzothiazole, 2-ethyl-2,3-dihydro- (9CI)

CAS No: 72889-30-6 Catalog No: AG00FF1P MDL No:

Product Description

Catalog Number:
AG00FF1P
Chemical Name:
Benzothiazole, 2-ethyl-2,3-dihydro- (9CI)
CAS Number:
72889-30-6
IUPAC Name:
2-ethyl-2,3-dihydro-1,3-benzothiazole
InChI:
InChI=1S/C9H11NS/c1-2-9-10-7-5-3-4-6-8(7)11-9/h3-6,9-10H,2H2,1H3
InChI Key:
QPDINLYPHRCUTL-UHFFFAOYSA-N

Properties

Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.061g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
165.254g/mol
Monoisotopic Mass:
165.061g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

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