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68981-84-0 | 4,4-Dimethyl-2-(4-methylpyridin-3-yl)-4,5-dihydrooxazole
CAS No: 68981-84-0 Catalog No: AG005ZFX MDL No:MFCD02090611
Product Description
Catalog Number:
AG005ZFX
Chemical Name:
4,4-Dimethyl-2-(4-methylpyridin-3-yl)-4,5-dihydrooxazole
CAS Number:
68981-84-0
Molecular Formula:
C11H14N2O
Molecular Weight:
190.2417
MDL Number:
MFCD02090611
IUPAC Name:
4,4-dimethyl-2-(4-methylpyridin-3-yl)-5H-1,3-oxazole
InChI:
InChI=1S/C11H14N2O/c1-8-4-5-12-6-9(8)10-13-11(2,3)7-14-10/h4-6H,7H2,1-3H3
InChI Key:
MWTCTUQKTUNCRO-UHFFFAOYSA-N
SMILES:
CC1(C)COC(=N1)c1cnccc1C
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.246g/mol
Monoisotopic Mass:
190.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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