4-[(2-methylimidazol-1-yl)methyl]aniline


Chemical Name: 4-[(2-methylimidazol-1-yl)methyl]aniline
CAS Number: 772311-98-5
Product Number: AG008NJU(AGN-PC-0MWV4B)
Synonyms:
MDL No:
Molecular Formula: C11H13N3
Molecular Weight: 187.2410

Identification/Properties


Computed Properties
Molecular Weight:
187.246g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
187.111g/mol
Monoisotopic Mass:
187.111g/mol
Topological Polar Surface Area:
43.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
175
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

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NMR Spectrum


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