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1030618-76-8 | 2,4-Dimethyl-6-(5-methyl-2H-pyrazol-3-yl)-phenylamine
CAS No: 1030618-76-8 Catalog No: AG01F858 MDL No:
Product Description
Catalog Number:
AG01F858
Chemical Name:
2,4-Dimethyl-6-(5-methyl-2H-pyrazol-3-yl)-phenylamine
CAS Number:
1030618-76-8
Molecular Formula:
C12H15N3
Molecular Weight:
201.2676
IUPAC Name:
2,4-dimethyl-6-(5-methyl-1H-pyrazol-3-yl)aniline
InChI:
InChI=1S/C12H15N3/c1-7-4-8(2)12(13)10(5-7)11-6-9(3)14-15-11/h4-6H,13H2,1-3H3,(H,14,15)
InChI Key:
PBEDLLCNBBRBHG-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1)c1[nH]nc(c1)C)N
Properties
Complexity:
219
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:
2
Isotope Atom Count:
0
Molecular Weight:
201.273g/mol
Monoisotopic Mass:
201.127g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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