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Home > Fluorides > 156215-40-6
156215-40-6 | Benzothiazole, 2-(3,5-difluorophenyl)-
CAS No: 156215-40-6 Catalog No: AG001OLV MDL No:
Product Description
Catalog Number:
AG001OLV
Chemical Name:
Benzothiazole, 2-(3,5-difluorophenyl)-
CAS Number:
156215-40-6
Molecular Formula:
C13H7F2NS
Molecular Weight:
247.2632
IUPAC Name:
2-(3,5-difluorophenyl)-1,3-benzothiazole
InChI:
InChI=1S/C13H7F2NS/c14-9-5-8(6-10(15)7-9)13-16-11-3-1-2-4-12(11)17-13/h1-7H
InChI Key:
OGYOVVLJBWGWNX-UHFFFAOYSA-N
SMILES:
Fc1cc(F)cc(c1)c1nc2c(s1)cccc2
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.027g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.263g/mol
Monoisotopic Mass:
247.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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