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89724-21-0 | 4-Oxazolemethanol, 5-(1-methylethyl)-2-(2-phenylethenyl)-
CAS No: 89724-21-0 Catalog No: AG004209 MDL No:
Product Description
Catalog Number:
AG004209
Chemical Name:
4-Oxazolemethanol, 5-(1-methylethyl)-2-(2-phenylethenyl)-
CAS Number:
89724-21-0
Molecular Formula:
C15H17NO2
Molecular Weight:
243.3010
IUPAC Name:
[2-(2-phenylethenyl)-5-propan-2-yl-1,3-oxazol-4-yl]methanol
InChI:
InChI=1S/C15H17NO2/c1-11(2)15-13(10-17)16-14(18-15)9-8-12-6-4-3-5-7-12/h3-9,11,17H,10H2,1-2H3
InChI Key:
HNIQEGLTRRFWKZ-UHFFFAOYSA-N
SMILES:
OCc1nc(oc1C(C)C)C=Cc1ccccc1
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.126g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.306g/mol
Monoisotopic Mass:
243.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3
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