Home Other Building Blocks 3-Hydroxy-5-(trifluoromethyl)-2,3-dihydrobenzothiophene1,1-Dioxide

3-Hydroxy-5-(trifluoromethyl)-2,3-dihydrobenzothiophene1,1-Dioxide

CAS No.:
2070896-47-6
Catalog Number:
AG01DF2O
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01DF2O
Chemical Name:
3-Hydroxy-5-(trifluoromethyl)-2,3-dihydrobenzothiophene1,1-Dioxide
CAS Number:
2070896-47-6
MDL Number:
MFCD30529789
IUPAC Name:
1,1-dioxo-5-(trifluoromethyl)-2,3-dihydro-1-benzothiophen-3-ol
InChI:
InChI=1S/C9H7F3O3S/c10-9(11,12)5-1-2-8-6(3-5)7(13)4-16(8,14)15/h1-3,7,13H,4H2
InChI Key:
ZDKNTCGWIWXAPH-UHFFFAOYSA-N
Properties
Complexity:
370  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.007g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
252.207g/mol
Monoisotopic Mass:
252.007g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties