Home Halogens 3-(3,5-dichlorophenyl)-3-hydroxy-2,2-dimethylpropanoic acid

3-(3,5-dichlorophenyl)-3-hydroxy-2,2-dimethylpropanoic acid

CAS No.:
1248997-05-8
Catalog Number:
AG01BVQP
Molecular Formula:
C11H12Cl2O3
Molecular Weight:
263.1172
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Product Description
Catalog Number:
AG01BVQP
Chemical Name:
3-(3,5-dichlorophenyl)-3-hydroxy-2,2-dimethylpropanoic acid
CAS Number:
1248997-05-8
Molecular Formula:
C11H12Cl2O3
Molecular Weight:
263.1172
MDL Number:
MFCD16757301
IUPAC Name:
3-(3,5-dichlorophenyl)-3-hydroxy-2,2-dimethylpropanoic acid
InChI:
InChI=1S/C11H12Cl2O3/c1-11(2,10(15)16)9(14)6-3-7(12)5-8(13)4-6/h3-5,9,14H,1-2H3,(H,15,16)
InChI Key:
MRIIZIFOBZCZMH-UHFFFAOYSA-N
SMILES:
OC(C(C(=O)O)(C)C)c1cc(Cl)cc(c1)Cl
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.016g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
263.114g/mol
Monoisotopic Mass:
262.016g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties