2,3-Dihydro-[1,4]dioxino[2,3-b]pyridine-8-carbonitrile - CAS 1246088-54-9
Catalog: |
BB005940 |
Product Name: |
2,3-Dihydro-[1,4]dioxino[2,3-b]pyridine-8-carbonitrile |
CAS: |
1246088-54-9 |
Synonyms: |
2,3-dihydro-[1,4]dioxino[2,3-b]pyridine-8-carbonitrile |
IUPAC Name: | 2,3-dihydro-[1,4]dioxino[2,3-b]pyridine-8-carbonitrile |
Description: | 2,3-Dihydro-[1,4]dioxino[2,3-b]pyridine-8-carbonitrile (CAS# 1246088-54-9) is a useful research chemical. |
Molecular Weight: | 162.15 |
Molecular Formula: | C8H6N2O2 |
Canonical SMILES: | C1COC2=NC=CC(=C2O1)C#N |
InChI: | InChI=1S/C8H6N2O2/c9-5-6-1-2-10-8-7(6)11-3-4-12-8/h1-2H,3-4H2 |
InChI Key: | XBICHAOWCZYJQF-UHFFFAOYSA-N |
Storage: | Sealed in dry, Room Temperature |
MDL: | MFCD17171315 |
LogP: | 0.72448 |
Publication Number | Title | Priority Date |
CA-2952307-A1 | 3-amino-1,5,6,7-tetrahydro-4h-indol-4-ones | 20140617 |
EP-3157914-A1 | 3-amino-1,5,6,7-tetrahydro-4h-indol-4-ones | 20140617 |
EP-3157914-B1 | 3-amino-1,5,6,7-tetrahydro-4h-indol-4-ones | 20140617 |
ES-2708211-T3 | 3-amino-1,5,6,7-tetrahydro-4H-indol-4-ones | 20140617 |
JP-2017526622-A | 3-Amino-1,5,6,7-tetrahydro-4H-indol-4-ones | 20140617 |
Complexity: | 210 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.042927438 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.042927438 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 55.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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Pyridines
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