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83687-74-5 | 2-Oxazolidinone, 5-(iodomethyl)-3-(phenylmethyl)-
CAS No: 83687-74-5 Catalog No: AG0056C4 MDL No:
Product Description
Catalog Number:
AG0056C4
Chemical Name:
2-Oxazolidinone, 5-(iodomethyl)-3-(phenylmethyl)-
CAS Number:
83687-74-5
Molecular Formula:
C11H12INO2
Molecular Weight:
317.1230
IUPAC Name:
3-benzyl-5-(iodomethyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C11H12INO2/c12-6-10-8-13(11(14)15-10)7-9-4-2-1-3-5-9/h1-5,10H,6-8H2
InChI Key:
WUTFZSZVMFQNNY-UHFFFAOYSA-N
SMILES:
ICC1CN(C(=O)O1)Cc1ccccc1
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.991g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
317.126g/mol
Monoisotopic Mass:
316.991g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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