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1263377-08-7 | 2,5-Dichloro-3,6-difluorothiophenol
CAS No: 1263377-08-7 Catalog No: AG01FDUV MDL No:MFCD18379848
Product Description
Catalog Number:
AG01FDUV
Chemical Name:
2,5-Dichloro-3,6-difluorothiophenol
CAS Number:
1263377-08-7
Molecular Formula:
C6H2Cl2F2S
Molecular Weight:
215.0479
MDL Number:
MFCD18379848
IUPAC Name:
2,5-dichloro-3,6-difluorobenzenethiol
InChI:
InChI=1S/C6H2Cl2F2S/c7-2-1-3(9)4(8)6(11)5(2)10/h1,11H
InChI Key:
BDBIXEWTFUDTRP-UHFFFAOYSA-N
SMILES:
Clc1cc(F)c(c(c1F)S)Cl
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.922g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.039g/mol
Monoisotopic Mass:
213.922g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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