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832076-71-8 | Oxazole, 2-[4-(1,1-dimethylethyl)phenyl]-4,5-dimethyl-
CAS No: 832076-71-8 Catalog No: AG008JCH MDL No:
Product Description
Catalog Number:
AG008JCH
Chemical Name:
Oxazole, 2-[4-(1,1-dimethylethyl)phenyl]-4,5-dimethyl-
CAS Number:
832076-71-8
Molecular Formula:
C15H19NO
Molecular Weight:
229.3175
IUPAC Name:
2-(4-tert-butylphenyl)-4,5-dimethyl-1,3-oxazole
InChI:
InChI=1S/C15H19NO/c1-10-11(2)17-14(16-10)12-6-8-13(9-7-12)15(3,4)5/h6-9H,1-5H3
InChI Key:
SJVSXNXOGXVWAX-UHFFFAOYSA-N
SMILES:
Cc1oc(nc1C)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.147g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.323g/mol
Monoisotopic Mass:
229.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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