Home Other Building Blocks 2-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]ethan-1-amine

2-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]ethan-1-amine

CAS No.:
616879-04-0
Catalog Number:
AG019NIN
Molecular Formula:
C13H17N3
Molecular Weight:
215.2942
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Product Description
Catalog Number:
AG019NIN
Chemical Name:
2-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]ethan-1-amine
CAS Number:
616879-04-0
Molecular Formula:
C13H17N3
Molecular Weight:
215.2942
MDL Number:
MFCD08443148
IUPAC Name:
2-[4-(3,5-dimethylpyrazol-1-yl)phenyl]ethanamine
InChI:
InChI=1S/C13H17N3/c1-10-9-11(2)16(15-10)13-5-3-12(4-6-13)7-8-14/h3-6,9H,7-8,14H2,1-2H3
InChI Key:
LBJNLRDAEIHAJO-UHFFFAOYSA-N
SMILES:
NCCc1ccc(cc1)n1nc(cc1C)C
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.142g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.3g/mol
Monoisotopic Mass:
215.142g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties