200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 1267981-92-9
1267981-92-9 | Methyl 4-(3-fluoro-4-methoxyphenyl)-4-oxobutyrate
CAS No: 1267981-92-9 Catalog No: AG01F988 MDL No:
Product Description
Catalog Number:
AG01F988
Chemical Name:
Methyl 4-(3-fluoro-4-methoxyphenyl)-4-oxobutyrate
CAS Number:
1267981-92-9
Molecular Formula:
C12H13FO4
Molecular Weight:
240.2276
IUPAC Name:
methyl 4-(3-fluoro-4-methoxyphenyl)-4-oxobutanoate
InChI:
InChI=1S/C12H13FO4/c1-16-11-5-3-8(7-9(11)13)10(14)4-6-12(15)17-2/h3,5,7H,4,6H2,1-2H3
InChI Key:
QTRNIULWKCWEQP-UHFFFAOYSA-N
SMILES:
COC(=O)CCC(=O)c1ccc(c(c1)F)OC
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.08g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.23g/mol
Monoisotopic Mass:
240.08g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.