1H-Pyrrole-3-carboxylic acid, 1-methyl-


Chemical Name: 1H-Pyrrole-3-carboxylic acid, 1-methyl-
CAS Number: 36929-61-0
Product Number: AG00CIQW(AGN-PC-0MZOU7)
Synonyms:
MDL No: MFCD11111733
Molecular Formula: C6H7NO2
Molecular Weight: 125.1253

Identification/Properties


Properties
MP:
145 - 145.5 °C
BP:
276.6°C at 760 mmHg
Storage:
2-8℃;Keep in dry area;
Form:
Solid
Computed Properties
Molecular Weight:
125.127g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
125.048g/mol
Monoisotopic Mass:
125.048g/mol
Topological Polar Surface Area:
42.2A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
124
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


NMR Spectrum


Other Analytical Data


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