200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 126814-93-5
126814-93-5 | 1,2-Propanediol, 3-[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)oxy]-
CAS No: 126814-93-5 Catalog No: AG000T9Y MDL No:
Product Description
Catalog Number:
AG000T9Y
Chemical Name:
1,2-Propanediol, 3-[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)oxy]-
CAS Number:
126814-93-5
Molecular Formula:
C11H11F13O3
Molecular Weight:
438.1825
IUPAC Name:
3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)propane-1,2-diol
InChI:
InChI=1S/C11H11F13O3/c12-6(13,1-2-27-4-5(26)3-25)7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)24/h5,25-26H,1-4H2
InChI Key:
XYEQEZYFDSQCMY-UHFFFAOYSA-N
SMILES:
OCC(COCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
Properties
Complexity:
488
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
438.05g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
16
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
438.185g/mol
Monoisotopic Mass:
438.05g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.