2-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine


Chemical Name: 2-[(2,3,4-trimethoxyphenyl)methyl]pyrazol-3-amine
CAS Number: 956780-52-2
Product Number: AG00IJC6(AGN-PC-0LK9CQ)
Synonyms:
MDL No: MFCD07323648
Molecular Formula: C13H17N3O3
Molecular Weight: 263.2924

Identification/Properties


Computed Properties
Molecular Weight:
263.297g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
5
Exact Mass:
263.127g/mol
Monoisotopic Mass:
263.127g/mol
Topological Polar Surface Area:
71.5A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
280
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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