Home Carboxys 4-Fluoro-1-methyl-1h-pyrrole-2-carboxylic acid

4-Fluoro-1-methyl-1h-pyrrole-2-carboxylic acid

CAS No.:
1783750-90-2
Catalog Number:
AG00HZTL
Molecular Formula:
C6H6FNO2
Molecular Weight:
143.1157
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Product Description
Catalog Number:
AG00HZTL
Chemical Name:
4-Fluoro-1-methyl-1h-pyrrole-2-carboxylic acid
CAS Number:
1783750-90-2
Molecular Formula:
C6H6FNO2
Molecular Weight:
143.1157
MDL Number:
MFCD27997491
IUPAC Name:
4-fluoro-1-methylpyrrole-2-carboxylic acid
InChI:
InChI=1S/C6H6FNO2/c1-8-3-4(7)2-5(8)6(9)10/h2-3H,1H3,(H,9,10)
InChI Key:
SGUPYQLZPKLQAW-UHFFFAOYSA-N
SMILES:
Cn1cc(cc1C(=O)O)F
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.038g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
143.117g/mol
Monoisotopic Mass:
143.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties