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13634-92-9

13634-92-9 | 2,3,6-Trifluorothiophenol

CAS No: 13634-92-9 Catalog No: AG01FFI2 MDL No:MFCD12922562

Product Description

Catalog Number:
AG01FFI2
Chemical Name:
2,3,6-Trifluorothiophenol
CAS Number:
13634-92-9
Molecular Formula:
C6H3F3S
Molecular Weight:
164.1482
MDL Number:
MFCD12922562
IUPAC Name:
2,3,6-trifluorobenzenethiol
InChI:
InChI=1S/C6H3F3S/c7-3-1-2-4(8)6(10)5(3)9/h1-2,10H
InChI Key:
MLVOAQKRZBBUPB-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1S)F)F

Properties

Complexity:
120  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.991g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.145g/mol
Monoisotopic Mass:
163.991g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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