Home Other Building Blocks 1H-Pyrazol-5-amine, 3-[4-(1,1-dimethylethyl)phenyl]-1-methyl-

1H-Pyrazol-5-amine, 3-[4-(1,1-dimethylethyl)phenyl]-1-methyl-

CAS No.:
175137-47-0
Catalog Number:
AG0020BO
Molecular Formula:
C14H19N3
Molecular Weight:
229.3208
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Product Description
Catalog Number:
AG0020BO
Chemical Name:
1H-Pyrazol-5-amine, 3-[4-(1,1-dimethylethyl)phenyl]-1-methyl-
CAS Number:
175137-47-0
Molecular Formula:
C14H19N3
Molecular Weight:
229.3208
MDL Number:
MFCD00067993
IUPAC Name:
5-(4-tert-butylphenyl)-2-methylpyrazol-3-amine
InChI:
InChI=1S/C14H19N3/c1-14(2,3)11-7-5-10(6-8-11)12-9-13(15)17(4)16-12/h5-9H,15H2,1-4H3
InChI Key:
IFLSIEYNHCORPD-UHFFFAOYSA-N
SMILES:
Cn1nc(cc1N)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.158g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.327g/mol
Monoisotopic Mass:
229.158g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties