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28465-86-3 | 1H-Pyrazol-4-amine, N,N-dimethyl-
CAS No: 28465-86-3 Catalog No: AG002VDB MDL No:
Product Description
Catalog Number:
AG002VDB
Chemical Name:
1H-Pyrazol-4-amine, N,N-dimethyl-
CAS Number:
28465-86-3
Molecular Formula:
C5H9N3
Molecular Weight:
111.1451
IUPAC Name:
N,N-dimethyl-1H-pyrazol-4-amine
InChI:
InChI=1S/C5H9N3/c1-8(2)5-3-6-7-4-5/h3-4H,1-2H3,(H,6,7)
InChI Key:
GEYCAYZYEXEBQG-UHFFFAOYSA-N
SMILES:
CN(c1c[nH]nc1)C
Properties
Complexity:
72.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.08g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
111.148g/mol
Monoisotopic Mass:
111.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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