Structure Info
- Chemspace ID
- CSSS00000217582 (In-Stock Screening Compounds)
- CAS
- 59719-78-7, 306956-12-7
- MFCD
- MFCD00100040
- IUPAC Name
- 4-tert-butyl-3-nitrobenzoic acid
- Mol formula
- C11H13NO4
- Mol weight
- 223 Da
- Catalog Number(s)
- 128710, 15R0817, 59719-78-7, A019101675, A899005, AA00EIRS, ACM59719787, ADB3474959001, AE-562/43286927, AG00EIUK, AG223277, AG77412, AO77412, AR00EJJK, ArZ-UP108334, ArZ-UP376273, ArZ-UP503936, B815033, BB4LS-15R0817, BB4LS-EN300-12399, BBV-001544, BD100311, BS-29105, BVV-821112603, CD12057312, CS-0071722, CSC000217582, EN300-12399, F2167-4296, F512069, FCG203630653, G20123, JCA71978, JH361715, LN01096380, NRB01030, OR76871, PB120067296, PB203318380, Y1126391, Y220285, Z119989828, ZX-AE048035, ZXC149409, ZXC219569
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.12
- Heavy atoms count
- 16
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.363
- Polar surface area (Å)
- 80
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00000217582
Items Overall 15 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 | |
| FCH Group | 5 days | Ukraine To: | 90 | 1 mg | 74 | |
| FCH Group | 5 days | Ukraine To: | 90 | 2 mg | 76 | |
| FCH Group | 5 days | Ukraine To: | 90 | 5 mg | 82 | |
| FCH Group | 5 days | Ukraine To: | 90 | 10 mg | 92 | |
| FCH Group | 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 |
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