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824933-13-3 | 2-Oxazolidinone, 5-(azidomethyl)-3-(1-oxo-3-phenyl-2-propenyl)-
CAS No: 824933-13-3 Catalog No: AG004VKM MDL No:
Product Description
Catalog Number:
AG004VKM
Chemical Name:
2-Oxazolidinone, 5-(azidomethyl)-3-(1-oxo-3-phenyl-2-propenyl)-
CAS Number:
824933-13-3
Molecular Formula:
C13H12N4O3
Molecular Weight:
272.2594
IUPAC Name:
5-(azidomethyl)-3-(3-phenylprop-2-enoyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C13H12N4O3/c14-16-15-8-11-9-17(13(19)20-11)12(18)7-6-10-4-2-1-3-5-10/h1-7,11H,8-9H2
InChI Key:
LABXFLJOHDFNJR-UHFFFAOYSA-N
SMILES:
O=C(N1CC(OC1=O)CN=[N+]=[N-])C=Cc1ccccc1
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.091g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.264g/mol
Monoisotopic Mass:
272.091g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
2.7
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