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83791-32-6 | 2,5-Oxazolidinedione, 4-(phenylmethylene)-
CAS No: 83791-32-6 Catalog No: AG004WL1 MDL No:
Product Description
Catalog Number:
AG004WL1
Chemical Name:
2,5-Oxazolidinedione, 4-(phenylmethylene)-
CAS Number:
83791-32-6
Molecular Formula:
C10H7NO3
Molecular Weight:
189.1675
IUPAC Name:
4-benzylidene-1,3-oxazolidine-2,5-dione
InChI:
InChI=1S/C10H7NO3/c12-9-8(11-10(13)14-9)6-7-4-2-1-3-5-7/h1-6H,(H,11,13)
InChI Key:
XIQDZBGJXQZZDQ-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)NC1=Cc1ccccc1
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.043g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.17g/mol
Monoisotopic Mass:
189.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
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