Name: Name:4-(4-ethoxy-3-fluorophenyl)-4-oxobutanoic acid
Brand: Angene
SKU: AG01ABSF
Rating: 90 (10 reviews)

4-(4-ethoxy-3-fluorophenyl)-4-oxobutanoic acid

CAS No.:

1797723-62-6

Catalog Number:

AG01ABSF

Molecular Formula:

C12H13FO4

Molecular Weight:

240.2276

Catalog Number:

AG01ABSF

Chemical Name:

4-(4-ethoxy-3-fluorophenyl)-4-oxobutanoic acid

CAS Number:

1797723-62-6

Molecular Formula:

C12H13FO4

Molecular Weight:

240.2276

MDL Number:

MFCD26935980

IUPAC Name:

4-(4-ethoxy-3-fluorophenyl)-4-oxobutanoic acid

InChI:

InChI=1S/C12H13FO4/c1-2-17-11-5-3-8(7-9(11)13)10(14)4-6-12(15)16/h3,5,7H,2,4,6H2,1H3,(H,15,16)

InChI Key:

HXZRWFLDERXQFQ-UHFFFAOYSA-N

SMILES:

CCOc1ccc(cc1F)C(=O)CCC(=O)O

Complexity:

280

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

240.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

240.23g/mol

Monoisotopic Mass:

240.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5