Drug-likeness Properties
sLogP
0.83036
HBD
0
HBA
3
AS100902-G1
Oxane
Tetrahydro-4H-pyran-4,4-dicarbonitrile 97%
CAS: 111511-90-1
Molecular Formula
C7H8N2O
Molecular Weight
136.15
MDL
MFCD19313175
Unit Size
Price per 1 g
€433.00
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PRODUCT ATTACHED TO REQUEST:
Tetrahydro-4H-pyran-4,4-dicarbonitrile 97%
Catalogue Number: AS100902-G1
C.A.S / related C.A.S
111511-90-1
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AS100902-G1
General Information
| Catalog #: | AS100902-G1 |
|---|---|
| Formula: | C7H8N2O |
| Mass: | 136.15 |
| C.A.S. / related C.A.S: | 111511-90-1 |
| MDL: | MFCD19313175 |
| Appearance: | solid |
| Colour: | clear |
| Hazardous Classification: | Achtung / Warning |
| Storage Temp: | 2-7°C Kühlschrank / Refrigerate |
| Dangerous Goods in Excepted Quantities: | |
| Tariff Code: | 2932990090 |
| Stock: | 0 |
| Material Safety Data Sheet: |
Computational Information
| SlogP: | 0.83036 |
|---|---|
| LabuteASA: | 59.82177715 |
| TPSA: | 56.81 |
| NumRotatableBonds: | 0 |
| NumHBD: | 0 |
| NumHBA: | 3 |
| NumHeavyAtoms: | 10 |
| NumRings: | 1 |