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89402-12-0 | 2,4-Oxazolidinedione, 5-bicyclo[3.1.0]hex-2-en-6-yl-
CAS No: 89402-12-0 Catalog No: AG004NE5 MDL No:
Product Description
Catalog Number:
AG004NE5
Chemical Name:
2,4-Oxazolidinedione, 5-bicyclo[3.1.0]hex-2-en-6-yl-
CAS Number:
89402-12-0
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
IUPAC Name:
5-(6-bicyclo[3.1.0]hex-2-enyl)-1,3-oxazolidine-2,4-dione
InChI:
InChI=1S/C9H9NO3/c11-8-7(13-9(12)10-8)6-4-2-1-3-5(4)6/h1-2,4-7H,3H2,(H,10,11,12)
InChI Key:
NPDJDDMFRFFMGT-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(O1)C1C2C1CC=C2
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.175g/mol
Monoisotopic Mass:
179.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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