1H-Pyrrole-3-carbonitrile, 2-amino-4,5-dimethyl-


Chemical Name: 1H-Pyrrole-3-carbonitrile, 2-amino-4,5-dimethyl-
CAS Number: 21392-51-8
Product Number: AG007QN5(AGN-PC-0KKL0Z)
Synonyms:
MDL No:
Molecular Formula: C7H9N3
Molecular Weight: 135.1665

Identification/Properties


Computed Properties
Molecular Weight:
135.17g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
135.08g/mol
Monoisotopic Mass:
135.08g/mol
Topological Polar Surface Area:
65.6A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
169
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#:
-
Hazard Statements:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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