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97438-03-4,MFCD09050209
Catalog No.:AA019VVF

97438-03-4 | 1-(4-chlorophenyl)-1H,4H,5H,6H,7H,8H-cyclohepta[c]pyrazole-3-carboxylic acid

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Technical Information
Catalog Number:
AA019VVF
Chemical Name:
1-(4-chlorophenyl)-1H,4H,5H,6H,7H,8H-cyclohepta[c]pyrazole-3-carboxylic acid
CAS Number:
97438-03-4
Molecular Formula:
C15H15ClN2O2
Molecular Weight:
290.7448
MDL Number:
MFCD09050209
SMILES:
Clc1ccc(cc1)n1nc(c2c1CCCCC2)C(=O)O
Properties
Computed Properties
 
Complexity:
358  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
4.1  

Literature
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Additional Info:
SDS
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Tags:97438-03-4 Molecular Formula|97438-03-4 MDL|97438-03-4 SMILES|97438-03-4 1-(4-chlorophenyl)-1H,4H,5H,6H,7H,8H-cyclohepta[c]pyrazole-3-carboxylic acid