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1349718-76-8 | 2-Cyclobutyl-5-phenyl-2H-pyrazol-3-ylamine
CAS No: 1349718-76-8 Catalog No: AG01FB8N MDL No:
Product Description
Catalog Number:
AG01FB8N
Chemical Name:
2-Cyclobutyl-5-phenyl-2H-pyrazol-3-ylamine
CAS Number:
1349718-76-8
Molecular Formula:
C13H15N3
Molecular Weight:
213.2783
IUPAC Name:
2-cyclobutyl-5-phenylpyrazol-3-amine
InChI:
InChI=1S/C13H15N3/c14-13-9-12(10-5-2-1-3-6-10)15-16(13)11-7-4-8-11/h1-3,5-6,9,11H,4,7-8,14H2
InChI Key:
RMYNGKAGNQSNMG-UHFFFAOYSA-N
SMILES:
Nc1cc(nn1C1CCC1)c1ccccc1
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.127g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.284g/mol
Monoisotopic Mass:
213.127g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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