200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 1443340-28-0
1443340-28-0 | 5-[3-(Trifluoromethoxy)phenyl]-5-oxovaleric acid
CAS No: 1443340-28-0 Catalog No: AG01F9L6 MDL No:
Product Description
Catalog Number:
AG01F9L6
Chemical Name:
5-[3-(Trifluoromethoxy)phenyl]-5-oxovaleric acid
CAS Number:
1443340-28-0
Molecular Formula:
C12H11F3O4
Molecular Weight:
276.2085
IUPAC Name:
5-oxo-5-[3-(trifluoromethoxy)phenyl]pentanoic acid
InChI:
InChI=1S/C12H11F3O4/c13-12(14,15)19-9-4-1-3-8(7-9)10(16)5-2-6-11(17)18/h1,3-4,7H,2,5-6H2,(H,17,18)
InChI Key:
JUGQXABMVBSUPQ-UHFFFAOYSA-N
SMILES:
OC(=O)CCCC(=O)c1cccc(c1)OC(F)(F)F
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.061g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
276.211g/mol
Monoisotopic Mass:
276.061g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.