Home Carboxys 4-(2-fluorophenyl)-1H-pyrrole-3-carboxylic acid

4-(2-fluorophenyl)-1H-pyrrole-3-carboxylic acid

CAS No.:
1096308-11-0
Catalog Number:
AG01BF9Y
Molecular Formula:
C11H8FNO2
Molecular Weight:
205.1851
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Product Description
Catalog Number:
AG01BF9Y
Chemical Name:
4-(2-fluorophenyl)-1H-pyrrole-3-carboxylic acid
CAS Number:
1096308-11-0
Molecular Formula:
C11H8FNO2
Molecular Weight:
205.1851
MDL Number:
MFCD09746414
IUPAC Name:
4-(2-fluorophenyl)-1H-pyrrole-3-carboxylic acid
InChI:
InChI=1S/C11H8FNO2/c12-10-4-2-1-3-7(10)8-5-13-6-9(8)11(14)15/h1-6,13H,(H,14,15)
InChI Key:
LPSXFYIOBIXUBL-UHFFFAOYSA-N
SMILES:
OC(=O)c1c[nH]cc1c1ccccc1F
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.054g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
205.188g/mol
Monoisotopic Mass:
205.054g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties