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7325-42-0 | 2-(pentan-3-ylidene)-3-phenyl-1,3-oxazolidine-4,5-dione
CAS No: 7325-42-0 Catalog No: AG005FIO MDL No:
Product Description
Catalog Number:
AG005FIO
Chemical Name:
2-(pentan-3-ylidene)-3-phenyl-1,3-oxazolidine-4,5-dione
CAS Number:
7325-42-0
Molecular Formula:
C14H15NO3
Molecular Weight:
245.2738
IUPAC Name:
2-pentan-3-ylidene-3-phenyl-1,3-oxazolidine-4,5-dione
InChI:
InChI=1S/C14H15NO3/c1-3-10(4-2)13-15(12(16)14(17)18-13)11-8-6-5-7-9-11/h5-9H,3-4H2,1-2H3
InChI Key:
MPOHPGROEOYNRR-UHFFFAOYSA-N
SMILES:
CCC(=C1OC(=O)C(=O)N1c1ccccc1)CC
NSC Number:
85015
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.105g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.278g/mol
Monoisotopic Mass:
245.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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