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Home > Pyridines > 1269291-15-7
1269291-15-7 | Pyridine, 4-[1-(1,1-dimethylethyl)-1H-pyrazol-5-yl]-
CAS No: 1269291-15-7 Catalog No: AG000TIE MDL No:MFCD20275475
Product Description
Catalog Number:
AG000TIE
Chemical Name:
Pyridine, 4-[1-(1,1-dimethylethyl)-1H-pyrazol-5-yl]-
CAS Number:
1269291-15-7
Molecular Formula:
C12H15N3
Molecular Weight:
201.2676
MDL Number:
MFCD20275475
IUPAC Name:
4-(2-tert-butylpyrazol-3-yl)pyridine
InChI:
InChI=1S/C12H15N3/c1-12(2,3)15-11(6-9-14-15)10-4-7-13-8-5-10/h4-9H,1-3H3
InChI Key:
DAUIPKGBDFZZKO-UHFFFAOYSA-N
SMILES:
CC(n1nccc1c1ccncc1)(C)C
Properties
Complexity:
203
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:
0
Isotope Atom Count:
0
Molecular Weight:
201.273g/mol
Monoisotopic Mass:
201.127g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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