Structure Info
- Chemspace ID
- CSSS00000690169 (In-Stock Screening Compounds)
- CAS
- 42872-74-2
- MFCD
- MFCD06797818
- IUPAC Name
- 3-bromo-4-methylbenzonitrile
- Mol formula
- C8H6BrN
- Mol weight
- 196 Da
- Catalog Number(s)
- 19223, 22609, 28989, 186782, 42872-74-2, A010003862, A223929, AA0033JI, AB44458, AC019693, ACDS-015689, ACM42872742, AD05163, AG0033MA, AJ44458, AOS0033MA, AR0034BA, AX151560, ArZ-UP077318, B697053, BB025266, BB4LS-PS-8275, BBV-33396711, BD85103, CB05273, CD12072331, CM158067, CS-W003347, CSC000690169, D18357, D388631, D488358, D690657, D954008, EN300-111680, F077916, FB55608, HTS060841, HY-W003347, J52320, JH685131, LAN-B23377, LN00009754, LQT-B23421, N651, OR3157, PB1255535681, PS-8275, R218373, RS20011433, SAB-006996, SC-51690, SY013763, Z1255458213, ZX-AE017019
- Dangerous substance
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.11
- Heavy atoms count
- 10
- Rotatable bond count
- 0
- 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
- CSSS00000690169
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 | 71 | |
| Enamine Ltd | 5 days | Ukraine To: | 90 | 2 mg | 73 | |
| Enamine Ltd | 5 days | Ukraine To: | 90 | 5 mg | 78 | |
| Enamine Ltd | 5 days | Ukraine To: | 90 | 10 mg | 87 | |
| Enamine Ltd | 5 days | Ukraine To: | 90 | 20 mg | 106 | |
| UORSY | 5 days | Ukraine To: | 90 | 1 mg | 71 | |
| UORSY | 5 days | Ukraine To: | 90 | 2 mg | 73 | |
| UORSY | 5 days | Ukraine To: | 90 | 5 mg | 78 | |
| UORSY | 5 days | Ukraine To: | 90 | 10 mg | 87 | |
| UORSY | 5 days | Ukraine To: | 90 | 20 mg | 106 | |
| Key Organics Limited (BIONET) | 10 days | United Kingdom To: | 97 | 1 mg | 48 | |
| Key Organics Limited (BIONET) | 10 days | United Kingdom To: | 97 | 5 mg | 61 | |
| Key Organics Limited (BIONET) | 10 days | United Kingdom To: | 97 | 10 mg | 82 |
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