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160349-69-9 | 2-Benzofurancarboxaldehyde, 3-azido-
CAS No: 160349-69-9 Catalog No: AG001RUD MDL No:
Product Description
Catalog Number:
AG001RUD
Chemical Name:
2-Benzofurancarboxaldehyde, 3-azido-
CAS Number:
160349-69-9
Molecular Formula:
C9H5N3O2
Molecular Weight:
187.1549
IUPAC Name:
3-azido-1-benzofuran-2-carbaldehyde
InChI:
InChI=1S/C9H5N3O2/c10-12-11-9-6-3-1-2-4-7(6)14-8(9)5-13/h1-5H
InChI Key:
AROBPMSQLIZFFO-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1c(C=O)oc2c1cccc2
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.038g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.158g/mol
Monoisotopic Mass:
187.038g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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