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116173-81-0 | Oxazole, 4,5-dihydro-2-methyl-4-phenyl-, (4R)-
CAS No: 116173-81-0 Catalog No: AG000BU1 MDL No:
Product Description
Catalog Number:
AG000BU1
Chemical Name:
Oxazole, 4,5-dihydro-2-methyl-4-phenyl-, (4R)-
CAS Number:
116173-81-0
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
IUPAC Name:
(4R)-2-methyl-4-phenyl-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C10H11NO/c1-8-11-10(7-12-8)9-5-3-2-4-6-9/h2-6,10H,7H2,1H3/t10-/m0/s1
InChI Key:
OADZSDHBFLIAPX-JTQLQIEISA-N
SMILES:
CC1=N[C@@H](CO1)c1ccccc1
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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