Home Other Building Blocks 4,4-DIFLUORO-3-PHENYLBUTANOIC ACID

4,4-DIFLUORO-3-PHENYLBUTANOIC ACID

CAS No.:
862458-16-0
Catalog Number:
AG01EK9F
Molecular Formula:
C10H10F2O2
Molecular Weight:
200.1820
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Product Description
Catalog Number:
AG01EK9F
Chemical Name:
4,4-DIFLUORO-3-PHENYLBUTANOIC ACID
CAS Number:
862458-16-0
Molecular Formula:
C10H10F2O2
Molecular Weight:
200.1820
MDL Number:
MFCD24654091
IUPAC Name:
4,4-difluoro-3-phenylbutanoic acid
InChI:
InChI=1S/C10H10F2O2/c11-10(12)8(6-9(13)14)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,13,14)
InChI Key:
ATTSUIJPZMICFB-UHFFFAOYSA-N
SMILES:
FC(C(c1ccccc1)CC(=O)O)F
Properties
Complexity:
189  
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:
4  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties