200,000+ products from a single source!
sales@angenechem.com
951889-89-7 | Ethyl 4-(3-Chloro-5-fluorophenyl)-4-oxobutanoate
CAS No: 951889-89-7 Catalog No: AG01F9OQ MDL No:
Product Description
Catalog Number:
AG01F9OQ
Chemical Name:
Ethyl 4-(3-Chloro-5-fluorophenyl)-4-oxobutanoate
CAS Number:
951889-89-7
Molecular Formula:
C12H12ClFO3
Molecular Weight:
258.6733
IUPAC Name:
ethyl 4-(3-chloro-5-fluorophenyl)-4-oxobutanoate
InChI:
InChI=1S/C12H12ClFO3/c1-2-17-12(16)4-3-11(15)8-5-9(13)7-10(14)6-8/h5-7H,2-4H2,1H3
InChI Key:
WUKZOMWINUNBNL-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCC(=O)c1cc(F)cc(c1)Cl
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.046g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.673g/mol
Monoisotopic Mass:
258.046g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
© 2019 Angene International Limited. All rights Reserved.