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1158094-31-5,MFCD11200643
Catalog No.:AA01BCX3

1158094-31-5 | 3-[2-(1H-pyrazol-1-yl)phenyl]prop-2-enoic acid

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Technical Information
Catalog Number:
AA01BCX3
Chemical Name:
3-[2-(1H-pyrazol-1-yl)phenyl]prop-2-enoic acid
CAS Number:
1158094-31-5
Molecular Formula:
C12H10N2O2
Molecular Weight:
214.2200
MDL Number:
MFCD11200643
SMILES:
OC(=O)C=Cc1ccccc1n1cccn1
Properties
Computed Properties
 
Complexity:
278  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.8  

Literature
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Additional Info:
SDS
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Tags:1158094-31-5 Molecular Formula|1158094-31-5 MDL|1158094-31-5 SMILES|1158094-31-5 3-[2-(1H-pyrazol-1-yl)phenyl]prop-2-enoic acid