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179873-43-9 | 1H-Pyrazole-4-methanamine, N,1-dimethyl-
CAS No: 179873-43-9 Catalog No: AG0027B2 MDL No:MFCD02090919
Product Description
Catalog Number:
AG0027B2
Chemical Name:
1H-Pyrazole-4-methanamine, N,1-dimethyl-
CAS Number:
179873-43-9
Molecular Formula:
C6H11N3
Molecular Weight:
125.1716
MDL Number:
MFCD02090919
IUPAC Name:
N-methyl-1-(1-methylpyrazol-4-yl)methanamine
InChI:
InChI=1S/C6H11N3/c1-7-3-6-4-8-9(2)5-6/h4-5,7H,3H2,1-2H3
InChI Key:
LEHGOSZFUSOULZ-UHFFFAOYSA-N
SMILES:
CNCc1cnn(c1)C
Properties
Complexity:
84.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.095g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
125.175g/mol
Monoisotopic Mass:
125.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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