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1325303-54-5 | 4-(Azidomethyl)-2-(4-ethoxy-3-methoxyphenyl)-5-methyl-1,3-oxazole
CAS No: 1325303-54-5 Catalog No: AG00HSNN MDL No:MFCD19705621
Product Description
Catalog Number:
AG00HSNN
Chemical Name:
4-(Azidomethyl)-2-(4-ethoxy-3-methoxyphenyl)-5-methyl-1,3-oxazole
CAS Number:
1325303-54-5
Molecular Formula:
C14H16N4O3
Molecular Weight:
288.3018
MDL Number:
MFCD19705621
IUPAC Name:
4-(azidomethyl)-2-(4-ethoxy-3-methoxyphenyl)-5-methyl-1,3-oxazole
InChI:
InChI=1S/C14H16N4O3/c1-4-20-12-6-5-10(7-13(12)19-3)14-17-11(8-16-18-15)9(2)21-14/h5-7H,4,8H2,1-3H3
InChI Key:
SKGVUFFKZHSJKV-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1OC)c1nc(c(o1)C)CN=[N+]=[N-]
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.122g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.307g/mol
Monoisotopic Mass:
288.122g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
58.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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