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88584-30-9 | 4-Oxazolecarboxamide, 5-ethoxy-N-(iminomethoxymethyl)-2-phenyl-
CAS No: 88584-30-9 Catalog No: AG004BD1 MDL No:
Product Description
Catalog Number:
AG004BD1
Chemical Name:
4-Oxazolecarboxamide, 5-ethoxy-N-(iminomethoxymethyl)-2-phenyl-
CAS Number:
88584-30-9
Molecular Formula:
C14H15N3O4
Molecular Weight:
289.2866
IUPAC Name:
[(5-ethoxy-2-phenyl-1,3-oxazole-4-carbonyl)amino]methyl methanimidate
InChI:
InChI=1S/C14H15N3O4/c1-2-20-14-11(12(18)16-9-19-8-15)17-13(21-14)10-6-4-3-5-7-10/h3-8,15H,2,9H2,1H3,(H,16,18)
InChI Key:
REPHOJHZLVHSJE-UHFFFAOYSA-N
SMILES:
CCOc1oc(nc1C(=O)NCOC=N)c1ccccc1
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.106g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
289.291g/mol
Monoisotopic Mass:
289.106g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
97.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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