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154327-25-0 | 4-Fluoro-2-(methylthio);benzo[d]thiazole
CAS No: 154327-25-0 Catalog No: AG003LCX MDL No:MFCD12756452
Product Description
Catalog Number:
AG003LCX
Chemical Name:
4-Fluoro-2-(methylthio);benzo[d]thiazole
CAS Number:
154327-25-0
Molecular Formula:
C8H6FNS2
Molecular Weight:
199.2683
MDL Number:
MFCD12756452
IUPAC Name:
4-fluoro-2-methylsulfanyl-1,3-benzothiazole
InChI:
InChI=1S/C8H6FNS2/c1-11-8-10-7-5(9)3-2-4-6(7)12-8/h2-4H,1H3
InChI Key:
PDJMWBTVBFQLAY-UHFFFAOYSA-N
SMILES:
CSc1sc2c(n1)c(F)ccc2
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.993g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.261g/mol
Monoisotopic Mass:
198.993g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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