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67880-11-9 | Acetaldehyde, azido-
CAS No: 67880-11-9 Catalog No: AG0062O4 MDL No:
Product Description
Catalog Number:
AG0062O4
Chemical Name:
Acetaldehyde, azido-
CAS Number:
67880-11-9
Molecular Formula:
C2H3N3O
Molecular Weight:
85.0647
IUPAC Name:
2-azidoacetaldehyde
InChI:
InChI=1S/C2H3N3O/c3-5-4-1-2-6/h2H,1H2
InChI Key:
FSLTZPDURFOPLT-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=NCC=O
Properties
Complexity:
82.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
85.028g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
85.066g/mol
Monoisotopic Mass:
85.028g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| Adamantyl ethanone pyridyl derivatives: potent and selective inhibitors of human 11β-hydroxysteroid dehydrogenase type 1. | ChemMedChem 20110905 |
| 1-(2-Azido-acet-yl)-3-methyl-2,6-diphenyl-piperidin-4-one. | Acta crystallographica. Section E, Structure reports online 20101101 |
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