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88332-38-1 | Oxazolidine, 3-[3-(4-fluorophenyl)-1-oxo-2-propenyl]-2,2-dimethyl-
CAS No: 88332-38-1 Catalog No: AG0047CS MDL No:
Product Description
Catalog Number:
AG0047CS
Chemical Name:
Oxazolidine, 3-[3-(4-fluorophenyl)-1-oxo-2-propenyl]-2,2-dimethyl-
CAS Number:
88332-38-1
Molecular Formula:
C14H16FNO2
Molecular Weight:
249.2807
IUPAC Name:
1-(2,2-dimethyl-1,3-oxazolidin-3-yl)-3-(4-fluorophenyl)prop-2-en-1-one
InChI:
InChI=1S/C14H16FNO2/c1-14(2)16(9-10-18-14)13(17)8-5-11-3-6-12(15)7-4-11/h3-8H,9-10H2,1-2H3
InChI Key:
JPERXBYBBXBRBZ-UHFFFAOYSA-N
SMILES:
O=C(N1CCOC1(C)C)C=Cc1ccc(cc1)F
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.117g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.285g/mol
Monoisotopic Mass:
249.117g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.2
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