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51769-43-8 | 2-(Methylthio)-beta-naphthothiazole
CAS No: 51769-43-8 Catalog No: AG003F3J MDL No:MFCD00600616
Product Description
Catalog Number:
AG003F3J
Chemical Name:
2-(Methylthio)-beta-naphthothiazole
CAS Number:
51769-43-8
MDL Number:
MFCD00600616
IUPAC Name:
2-methylsulfanylbenzo[e][1,3]benzothiazole
InChI:
InChI=1S/C12H9NS2/c1-14-12-13-11-9-5-3-2-4-8(9)6-7-10(11)15-12/h2-7H,1H3
InChI Key:
NCJSBVUUUHBCQS-UHFFFAOYSA-N
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.018g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.331g/mol
Monoisotopic Mass:
231.018g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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