Home Other Building Blocks 3-(4-fluorophenyl)-2-methylbutanoic acid

3-(4-fluorophenyl)-2-methylbutanoic acid

CAS No.:
1490400-07-1
Catalog Number:
AG01DVDK
Molecular Formula:
C11H13FO2
Molecular Weight:
196.2181
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DVDK
Chemical Name:
3-(4-fluorophenyl)-2-methylbutanoic acid
CAS Number:
1490400-07-1
Molecular Formula:
C11H13FO2
Molecular Weight:
196.2181
MDL Number:
MFCD23756112
IUPAC Name:
3-(4-fluorophenyl)-2-methylbutanoic acid
InChI:
InChI=1S/C11H13FO2/c1-7(8(2)11(13)14)9-3-5-10(12)6-4-9/h3-8H,1-2H3,(H,13,14)
InChI Key:
PJHOABNDOPVMNW-UHFFFAOYSA-N
SMILES:
CC(C(C(=O)O)C)c1ccc(cc1)F
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.09g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
196.221g/mol
Monoisotopic Mass:
196.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties