Structure Info
- Chemspace ID
- CSSS00000060123 (In-Stock Screening Compounds)
- CAS
- 161320-00-9, 1436329-44-0, 1216676-41-3
- MFCD
- MFCD08458134
- IUPAC Name
- 4-iodo-3-(trifluoromethyl)benzonitrile
- Mol formula
- C8H3F3IN
- Mol weight
- 297 Da
- Catalog Number(s)
- 161320-00-9, 8159AA, A013034439, A444757, AA001S9L, AA83189, ACM161320009, AFI161320009, AG001SCD, AG209619, AI83189, AOS001SCD, AR001T1D, ArZ-UP120561, BB011725, BB4LS-EN300-67483, BBV-40201210, BD98083, C33721, CD12136541, CL9421, CS-W009967, CSC000060123, D952385, EN300-67483, F034798, FI84407, HY-W009251, I737265, JH164604, K67784, LN01358618, PB1080454326, PB1245724301, PC9307, PS-7151, SAB-074591, W167566, WLZ1765, Z1080376858, ZX-AE060262
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.64
- Heavy atoms count
- 13
- Rotatable bond count
- 1
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.125
- Polar surface area (Å)
- 24
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSS00000060123
Items Overall 13 items from 3 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd | 5 days | Ukraine To: | 90 | 1 mg | 74 | |
| Enamine Ltd | 5 days | Ukraine To: | 90 | 2 mg | 76 | |
| Enamine Ltd | 5 days | Ukraine To: | 90 | 5 mg | 82 | |
| Enamine Ltd | 5 days | Ukraine To: | 90 | 10 mg | 92 | |
| Enamine Ltd | 5 days | Ukraine To: | 90 | 20 mg | 111 | |
| UORSY | 5 days | Ukraine To: | 90 | 1 mg | 74 | |
| UORSY | 5 days | Ukraine To: | 90 | 2 mg | 76 | |
| UORSY | 5 days | Ukraine To: | 90 | 5 mg | 82 | |
| UORSY | 5 days | Ukraine To: | 90 | 10 mg | 92 | |
| UORSY | 5 days | Ukraine To: | 90 | 20 mg | 111 | |
| Key Organics Limited (BIONET) | 10 days | United Kingdom To: | 90 | 1 mg | 51 | |
| Key Organics Limited (BIONET) | 10 days | United Kingdom To: | 90 | 5 mg | 63 | |
| Key Organics Limited (BIONET) | 10 days | United Kingdom To: | 90 | 10 mg | 86 |
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