200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 189828-71-5
189828-71-5 | Methanone, [5,6-dihydroxy-2-(trifluoromethyl)-3-benzofuranyl]-2-thienyl-
CAS No: 189828-71-5 Catalog No: AG002E0X MDL No:
Product Description
Catalog Number:
AG002E0X
Chemical Name:
Methanone, [5,6-dihydroxy-2-(trifluoromethyl)-3-benzofuranyl]-2-thienyl-
CAS Number:
189828-71-5
Molecular Formula:
C14H7F3O4S
Molecular Weight:
328.2632
IUPAC Name:
[5,6-dihydroxy-2-(trifluoromethyl)-1-benzofuran-3-yl]-thiophen-2-ylmethanone
InChI:
InChI=1S/C14H7F3O4S/c15-14(16,17)13-11(12(20)10-2-1-3-22-10)6-4-7(18)8(19)5-9(6)21-13/h1-5,18-19H
InChI Key:
BGLNTYIMHGETFV-UHFFFAOYSA-N
SMILES:
Oc1cc2oc(c(c2cc1O)C(=O)c1cccs1)C(F)(F)F
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.002g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
328.261g/mol
Monoisotopic Mass:
328.002g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
98.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.