200,000+ products from a single source!
sales@angenechem.com
295360-08-6 | Butanoic acid, 4-cyano-2,2-difluoro-, ethyl ester
CAS No: 295360-08-6 Catalog No: AG002YOA MDL No:
Product Description
Catalog Number:
AG002YOA
Chemical Name:
Butanoic acid, 4-cyano-2,2-difluoro-, ethyl ester
CAS Number:
295360-08-6
Molecular Formula:
C7H9F2NO2
Molecular Weight:
177.1487
IUPAC Name:
ethyl 4-cyano-2,2-difluorobutanoate
InChI:
InChI=1S/C7H9F2NO2/c1-2-12-6(11)7(8,9)4-3-5-10/h2-4H2,1H3
InChI Key:
CKXPGHFIUHPUEK-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(CCC#N)(F)F
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.06g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.151g/mol
Monoisotopic Mass:
177.06g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.