Home Carboxys 1H-Pyrrole-2,5-dicarboxylic acid, monomethyl ester

1H-Pyrrole-2,5-dicarboxylic acid, monomethyl ester

CAS No.:
1199-64-0
Catalog Number:
AG01ALE2
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01ALE2
Chemical Name:
1H-Pyrrole-2,5-dicarboxylic acid, monomethyl ester
CAS Number:
1199-64-0
MDL Number:
MFCD12402324
IUPAC Name:
5-methoxycarbonyl-1H-pyrrole-2-carboxylic acid
InChI:
InChI=1S/C7H7NO4/c1-12-7(11)5-3-2-4(8-5)6(9)10/h2-3,8H,1H3,(H,9,10)
InChI Key:
RSCFOPAKJCCZNX-UHFFFAOYSA-N
Properties
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.038g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
169.136g/mol
Monoisotopic Mass:
169.038g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties