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

(2R)-2-(4-Fluorophenyl)-3-methylbutanoic acid

CAS No.:
110311-45-0
Catalog Number:
AG008QZW
Molecular Formula:
C11H13FO2
Molecular Weight:
196.2181
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Product Description
Catalog Number:
AG008QZW
Chemical Name:
(2R)-2-(4-Fluorophenyl)-3-methylbutanoic acid
CAS Number:
110311-45-0
Molecular Formula:
C11H13FO2
Molecular Weight:
196.2181
MDL Number:
MFCD00792491
IUPAC Name:
(2R)-2-(4-fluorophenyl)-3-methylbutanoic acid
InChI:
InChI=1S/C11H13FO2/c1-7(2)10(11(13)14)8-3-5-9(12)6-4-8/h3-7,10H,1-2H3,(H,13,14)/t10-/m1/s1
InChI Key:
YBQLHBYGMUXCEW-SNVBAGLBSA-N
SMILES:
CC([C@@H](c1ccc(cc1)F)C(=O)O)C
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties