200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 115479-06-6
115479-06-6 | Hexanoic acid, 2-acetyl-4,4,5,5,6,6,6-heptafluoro-3-oxo-, ethyl ester
CAS No: 115479-06-6 Catalog No: AG000G20 MDL No:
Product Description
Catalog Number:
AG000G20
Chemical Name:
Hexanoic acid, 2-acetyl-4,4,5,5,6,6,6-heptafluoro-3-oxo-, ethyl ester
CAS Number:
115479-06-6
Molecular Formula:
C10H9F7O4
Molecular Weight:
326.1649
IUPAC Name:
ethyl 2-acetyl-4,4,5,5,6,6,6-heptafluoro-3-oxohexanoate
InChI:
InChI=1S/C10H9F7O4/c1-3-21-7(20)5(4(2)18)6(19)8(11,12)9(13,14)10(15,16)17/h5H,3H2,1-2H3
InChI Key:
MZZDFAKNMZPUCE-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(=O)C(C(C(F)(F)F)(F)F)(F)F)C(=O)C
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.039g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
11
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.167g/mol
Monoisotopic Mass:
326.039g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.