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2510-33-0

2510-33-0 | 2-Oxazolidinone, 3-(phenylmethyl)-

CAS No: 2510-33-0 Catalog No: AG002QH2 MDL No:

Product Description

Catalog Number:
AG002QH2
Chemical Name:
2-Oxazolidinone, 3-(phenylmethyl)-
CAS Number:
2510-33-0
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
IUPAC Name:
3-benzyl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C10H11NO2/c12-10-11(6-7-13-10)8-9-4-2-1-3-5-9/h1-5H,6-8H2
InChI Key:
DBVTYDLZMXNRIN-UHFFFAOYSA-N
SMILES:
O=C1OCCN1Cc1ccccc1

Properties

Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

Literature

Title Journal
Synthesis of tetra-ortho-substituted, phosphorus-containing and carbonyl-containing biaryls utilizing a Diels-Alder approach. Journal of the American Chemical Society 20070725

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