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7208-05-1 | 2,4-Dimethyloxazole
CAS No: 7208-05-1 Catalog No: AG003FUI MDL No:MFCD00234124
Product Description
Catalog Number:
AG003FUI
Chemical Name:
2,4-Dimethyloxazole
CAS Number:
7208-05-1
Molecular Formula:
C5H7NO
Molecular Weight:
97.1152
MDL Number:
MFCD00234124
IUPAC Name:
2,4-dimethyl-1,3-oxazole
InChI:
InChI=1S/C5H7NO/c1-4-3-7-5(2)6-4/h3H,1-2H3
InChI Key:
PSOZJOZKEVZLKZ-UHFFFAOYSA-N
SMILES:
Cc1occ(n1)C
UNII:
G0W5QQT2LD
Properties
Complexity:
65.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
97.053g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
97.117g/mol
Monoisotopic Mass:
97.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| Aminopyrazine inhibitors binding to an unusual inactive conformation of the mitotic kinase Nek2: SAR and structural characterization. | Journal of medicinal chemistry 20101111 |
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