1H-Pyrrole-3-carboxylic acid, 2,4-dimethyl-


Chemical Name: 1H-Pyrrole-3-carboxylic acid, 2,4-dimethyl-
CAS Number: 17106-13-7
Product Number: AG0037OM(AGN-PC-0KNXH3)
Synonyms:
MDL No:
Molecular Formula: C7H9NO2
Molecular Weight: 139.1519

Identification/Properties


Properties
BP:
315.186°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
139.154g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
139.063g/mol
Monoisotopic Mass:
139.063g/mol
Topological Polar Surface Area:
53.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
147
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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