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35691-34-0 | 1,2,3,6-tetrahydropyridazine
CAS No: 35691-34-0 Catalog No: AG01AMPF MDL No:MFCD30344723
Product Description
Catalog Number:
AG01AMPF
Chemical Name:
1,2,3,6-tetrahydropyridazine
CAS Number:
35691-34-0
Molecular Formula:
C4H8N2
Molecular Weight:
84.1197
MDL Number:
MFCD30344723
IUPAC Name:
1,2,3,6-tetrahydropyridazine
InChI:
InChI=1S/C4H8N2/c1-2-4-6-5-3-1/h1-2,5-6H,3-4H2
InChI Key:
WNSPCCWAAVHWIM-UHFFFAOYSA-N
SMILES:
N1NCC=CC1
Properties
Complexity:
50.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
84.069g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
84.122g/mol
Monoisotopic Mass:
84.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
Literature
| Title | Journal |
|---|---|
| 2-(Acetoxymethyl)buta-2,3-dienoate, a versatile 1,4-biselectrophile for phosphine-catalyzed (4 + n) annulations with 1,n-Bisnucleophiles (n = 1, 2). | Journal of the American Chemical Society 20100303 |
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