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133164-40-6,MFCD28976645
Catalog No.:AA00J077

133164-40-6 | (1S)-1-(2-Chlorophenyl)-2,2-dimethylpropane-1,3-diol

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Technical Information
Catalog Number:
AA00J077
Chemical Name:
(1S)-1-(2-Chlorophenyl)-2,2-dimethylpropane-1,3-diol
CAS Number:
133164-40-6
Molecular Formula:
C11H15ClO2
Molecular Weight:
214.6886
MDL Number:
MFCD28976645
SMILES:
OCC([C@@H](c1ccccc1Cl)O)(C)C
Properties
Computed Properties
 
Complexity:
182  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
2.2  

Literature
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SDS
Tags:133164-40-6 Molecular Formula|133164-40-6 MDL|133164-40-6 SMILES|133164-40-6 (1S)-1-(2-Chlorophenyl)-2,2-dimethylpropane-1,3-diol