Home Other Building Blocks 3-(2,4-difluorophenyl)but-2-enoic acid

3-(2,4-difluorophenyl)but-2-enoic acid

CAS No.:
1049158-14-6
Catalog Number:
AG01E8HC
Molecular Formula:
C10H8F2O2
Molecular Weight:
198.1661
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01E8HC
Chemical Name:
3-(2,4-difluorophenyl)but-2-enoic acid
CAS Number:
1049158-14-6
Molecular Formula:
C10H8F2O2
Molecular Weight:
198.1661
MDL Number:
MFCD11172865
IUPAC Name:
(E)-3-(2,4-difluorophenyl)but-2-enoic acid
InChI:
InChI=1S/C10H8F2O2/c1-6(4-10(13)14)8-3-2-7(11)5-9(8)12/h2-5H,1H3,(H,13,14)/b6-4+
InChI Key:
VHCAKIKWZJMZGF-GQCTYLIASA-N
SMILES:
OC(=O)C=C(c1ccc(cc1F)F)C
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
198.049g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.169g/mol
Monoisotopic Mass:
198.049g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties