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Home Other Building Blocks 4-(4-Chloro-3-fluorophenyl)-4-oxobutanoic acid

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

CAS No.:
142048-54-2
Catalog Number:
AG001HMF
Molecular Formula:
C10H8ClFO3
Molecular Weight:
230.6201
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$330
- +
5g
95%
1 week
United States
$1170
- +
Product Description
Catalog Number:
AG001HMF
Chemical Name:
4-(4-Chloro-3-fluorophenyl)-4-oxobutanoic acid
CAS Number:
142048-54-2
Molecular Formula:
C10H8ClFO3
Molecular Weight:
230.6201
MDL Number:
MFCD06201693
IUPAC Name:
4-(4-chloro-3-fluorophenyl)-4-oxobutanoic acid
InChI:
InChI=1S/C10H8ClFO3/c11-7-2-1-6(5-8(7)12)9(13)3-4-10(14)15/h1-2,5H,3-4H2,(H,14,15)
InChI Key:
IRQZAGWHZPBKOD-UHFFFAOYSA-N
SMILES:
OC(=O)CCC(=O)c1ccc(c(c1)F)Cl
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.015g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
230.619g/mol
Monoisotopic Mass:
230.015g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties