Home Other Building Blocks (1-benzyl-3-phenyl-1H-pyrazol-4-yl)methanamine

(1-benzyl-3-phenyl-1H-pyrazol-4-yl)methanamine

CAS No.:
956726-82-2
Catalog Number:
AG019KD5
Molecular Formula:
C17H17N3
Molecular Weight:
263.3370
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Product Description
Catalog Number:
AG019KD5
Chemical Name:
(1-benzyl-3-phenyl-1H-pyrazol-4-yl)methanamine
CAS Number:
956726-82-2
Molecular Formula:
C17H17N3
Molecular Weight:
263.3370
MDL Number:
MFCD08691346
IUPAC Name:
(1-benzyl-3-phenylpyrazol-4-yl)methanamine
InChI:
InChI=1S/C17H17N3/c18-11-16-13-20(12-14-7-3-1-4-8-14)19-17(16)15-9-5-2-6-10-15/h1-10,13H,11-12,18H2
InChI Key:
UPIXZRBUSDMNDT-UHFFFAOYSA-N
SMILES:
NCc1cn(nc1c1ccccc1)Cc1ccccc1
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.142g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
263.344g/mol
Monoisotopic Mass:
263.142g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties