Home Carboxys 1H-pyrrole-3-carboxylic acid

1H-pyrrole-3-carboxylic acid

CAS No.:
336100-46-0
Catalog Number:
AG019DJW
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG019DJW
Chemical Name:
1H-pyrrole-3-carboxylic acid
CAS Number:
336100-46-0
MDL Number:
MFCD06201862
IUPAC Name:
1H-pyrrole-3-carboxylic acid;hydrate
InChI:
InChI=1S/C5H5NO2.H2O/c7-5(8)4-1-2-6-3-4;/h1-3,6H,(H,7,8);1H2
InChI Key:
CFVUWWPGGBWCTB-UHFFFAOYSA-N
Properties
Complexity:
103  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.043g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
129.115g/mol
Monoisotopic Mass:
129.043g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties