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835632-83-2 | 2-Oxazolidinone, 3-[(1R,2S,5R)-3-oxobicyclo[3.2.1]oct-6-en-2-yl]-
CAS No: 835632-83-2 Catalog No: AG008IZI MDL No:
Product Description
Catalog Number:
AG008IZI
Chemical Name:
2-Oxazolidinone, 3-[(1R,2S,5R)-3-oxobicyclo[3.2.1]oct-6-en-2-yl]-
CAS Number:
835632-83-2
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
IUPAC Name:
3-[(1R,2S,5R)-3-oxo-2-bicyclo[3.2.1]oct-6-enyl]-1,3-oxazolidin-2-one
InChI:
InChI=1S/C11H13NO3/c13-9-6-7-1-2-8(5-7)10(9)12-3-4-15-11(12)14/h1-2,7-8,10H,3-6H2/t7-,8+,10+/m1/s1
InChI Key:
YDTKLPCKPWXKQB-WEDXCCLWSA-N
SMILES:
O=C1C[C@@H]2C=C[C@H]([C@@H]1N1CCOC1=O)C2
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
207.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.229g/mol
Monoisotopic Mass:
207.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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