In Stock
Drug-likeness Properties
sLogP
2.18598
HBD
1
HBA
2
AS16643-G1
Carboxylic acids
Benzene
3-(2-Cyanopropan-2-yl)benzoic acid 98%
CAS: 872091-00-4
Molecular Formula
C11H11NO2
Molecular Weight
189.21
MDL
MFCD19694856
Unit Size
Price per 1 g
€55.00
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PRODUCT ATTACHED TO REQUEST:
3-(2-Cyanopropan-2-yl)benzoic acid 98%
Catalogue Number: AS16643-G1
C.A.S / related C.A.S
872091-00-4
Quality Guarantee
All products are tested and certified with CoA available upon request.
AS16643-G1
General Information
| Catalog #: | AS16643-G1 |
|---|---|
| Formula: | C11H11NO2 |
| Mass: | 189.21 |
| C.A.S. / related C.A.S: | 872091-00-4 |
| MDL: | MFCD19694856 |
| Appearance: | solid |
| Colour: | white to off-white |
| Hazardous Classification: | Achtung / Warning |
| Storage Temp: | 2-7°C Kühlschrank / Refrigerate |
| Dangerous Goods in Excepted Quantities: | |
| Tariff Code: | 2926907090 |
| Stock: | > 5 |
| Material Safety Data Sheet: |
Computational Information
| SlogP: | 2.18598 |
|---|---|
| LabuteASA: | 82.60444923 |
| TPSA: | 61.09 |
| NumRotatableBonds: | 2 |
| NumHBD: | 1 |
| NumHBA: | 2 |
| NumHeavyAtoms: | 14 |
| NumRings: | 1 |