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132389-09-4 | Methyl 3-Hydroxy-5-(Trifluoromethyl)Benzo[B]Thiophene-2-Carboxylate
CAS No: 132389-09-4 Catalog No: AG01FLFJ MDL No:MFCD29375607
Product Description
Catalog Number:
AG01FLFJ
Chemical Name:
Methyl 3-Hydroxy-5-(Trifluoromethyl)Benzo[B]Thiophene-2-Carboxylate
CAS Number:
132389-09-4
MDL Number:
MFCD29375607
IUPAC Name:
methyl 3-hydroxy-5-(trifluoromethyl)-1-benzothiophene-2-carboxylate
InChI:
InChI=1S/C11H7F3O3S/c1-17-10(16)9-8(15)6-4-5(11(12,13)14)2-3-7(6)18-9/h2-4,15H,1H3
InChI Key:
CPPHJOZCNNWMLB-UHFFFAOYSA-N
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.007g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
276.229g/mol
Monoisotopic Mass:
276.007g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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