Home Other Building Blocks 2-hydroxy-3-(4-methylphenyl)butanoic acid

2-hydroxy-3-(4-methylphenyl)butanoic acid

CAS No.:
1354961-66-2
Catalog Number:
AG019T7M
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
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Product Description
Catalog Number:
AG019T7M
Chemical Name:
2-hydroxy-3-(4-methylphenyl)butanoic acid
CAS Number:
1354961-66-2
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
MDL Number:
MFCD20731239
IUPAC Name:
2-hydroxy-3-(4-methylphenyl)butanoic acid
InChI:
InChI=1S/C11H14O3/c1-7-3-5-9(6-4-7)8(2)10(12)11(13)14/h3-6,8,10,12H,1-2H3,(H,13,14)
InChI Key:
OIRVHNSYMGLIKL-UHFFFAOYSA-N
SMILES:
CC(C(C(=O)O)O)c1ccc(cc1)C
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties