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1397199-82-4 | Ethanone, 2-azido-1-(2-benzofuranyl)-
CAS No: 1397199-82-4 Catalog No: AG001BKY MDL No:
Product Description
Catalog Number:
AG001BKY
Chemical Name:
Ethanone, 2-azido-1-(2-benzofuranyl)-
CAS Number:
1397199-82-4
Molecular Formula:
C10H7N3O2
Molecular Weight:
201.1815
IUPAC Name:
2-azido-1-(1-benzofuran-2-yl)ethanone
InChI:
InChI=1S/C10H7N3O2/c11-13-12-6-8(14)10-5-7-3-1-2-4-9(7)15-10/h1-5H,6H2
InChI Key:
SVLNHPBCTQFFLO-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=NCC(=O)c1cc2c(o1)cccc2
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.054g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.185g/mol
Monoisotopic Mass:
201.054g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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