200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 175286-67-6
175286-67-6 | 3,3-Difluorohexanoic acid ethyl ester
CAS No: 175286-67-6 Catalog No: AG01FD8B MDL No:MFCD28166146
Product Description
Catalog Number:
AG01FD8B
Chemical Name:
3,3-Difluorohexanoic acid ethyl ester
CAS Number:
175286-67-6
Molecular Formula:
C8H14F2O2
Molecular Weight:
180.1924
MDL Number:
MFCD28166146
IUPAC Name:
ethyl 3,3-difluorohexanoate
InChI:
InChI=1S/C8H14F2O2/c1-3-5-8(9,10)6-7(11)12-4-2/h3-6H2,1-2H3
InChI Key:
NBTHBUIFJZZLIE-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(CCC)(F)F
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.096g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.195g/mol
Monoisotopic Mass:
180.096g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.