Home Other Building Blocks 3-(3,4-DIFLUOROPHENYL)-2-METHYLPROPANOIC ACID

3-(3,4-DIFLUOROPHENYL)-2-METHYLPROPANOIC ACID

CAS No.:
32004-56-1
Catalog Number:
AG01DWC4
Molecular Formula:
C10H10F2O2
Molecular Weight:
200.1820
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Product Description
Catalog Number:
AG01DWC4
Chemical Name:
3-(3,4-DIFLUOROPHENYL)-2-METHYLPROPANOIC ACID
CAS Number:
32004-56-1
Molecular Formula:
C10H10F2O2
Molecular Weight:
200.1820
MDL Number:
MFCD23756136
IUPAC Name:
3-(3,4-difluorophenyl)-2-methylpropanoic acid
InChI:
InChI=1S/C10H10F2O2/c1-6(10(13)14)4-7-2-3-8(11)9(12)5-7/h2-3,5-6H,4H2,1H3,(H,13,14)
InChI Key:
UBWKSHCOWRUZGP-UHFFFAOYSA-N
SMILES:
OC(=O)C(Cc1ccc(c(c1)F)F)C
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.065g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.185g/mol
Monoisotopic Mass:
200.065g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties