Home Other Building Blocks 1H-Pyrazole-5-methanamine,N,1-dimethyl-3-phenyl-

1H-Pyrazole-5-methanamine,N,1-dimethyl-3-phenyl-

CAS No.:
864068-98-4
Catalog Number:
AG008GD8
Molecular Formula:
C12H15N3
Molecular Weight:
201.2676
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Product Description
Catalog Number:
AG008GD8
Chemical Name:
1H-Pyrazole-5-methanamine,N,1-dimethyl-3-phenyl-
CAS Number:
864068-98-4
Molecular Formula:
C12H15N3
Molecular Weight:
201.2676
MDL Number:
MFCD08271945
IUPAC Name:
N-methyl-1-(2-methyl-5-phenylpyrazol-3-yl)methanamine
InChI:
InChI=1S/C12H15N3/c1-13-9-11-8-12(14-15(11)2)10-6-4-3-5-7-10/h3-8,13H,9H2,1-2H3
InChI Key:
QFUHILGXHQHXHY-UHFFFAOYSA-N
SMILES:
CNCc1cc(nn1C)c1ccccc1
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.127g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
201.273g/mol
Monoisotopic Mass:
201.127g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties