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827303-01-5 | Oxazole, 5-methyl-4-phenyl-2-(1-propenyl)-
CAS No: 827303-01-5 Catalog No: AG0059FR MDL No:
Product Description
Catalog Number:
AG0059FR
Chemical Name:
Oxazole, 5-methyl-4-phenyl-2-(1-propenyl)-
CAS Number:
827303-01-5
Molecular Formula:
C13H13NO
Molecular Weight:
199.2484
IUPAC Name:
5-methyl-4-phenyl-2-prop-1-enyl-1,3-oxazole
InChI:
InChI=1S/C13H13NO/c1-3-7-12-14-13(10(2)15-12)11-8-5-4-6-9-11/h3-9H,1-2H3
InChI Key:
MXKCYETXULVQHO-UHFFFAOYSA-N
SMILES:
CC=Cc1oc(c(n1)c1ccccc1)C
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.1g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.253g/mol
Monoisotopic Mass:
199.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.4
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