2-{[(1,3-dioxo-2,3-dihydro-1H-inden-2-ylidene)methyl]amino}-5-methylbenzoic acid
Structure Info
- Chemspace ID
- CSSB00020607129 (In-Stock Building Blocks)
- MFCD
- MFCD00245541
- IUPAC Name
- 2-{[(1,3-dioxo-2,3-dihydro-1H-inden-2-ylidene)methyl]amino}-5-methylbenzoic acid
- Mol formula
- C18H13NO4
- Mol weight
- 307 Da
- Catalog Number(s)
- AA00IV5Y, AGN-PC-0WB1SG, AGNPC-0WB1SG, AI80098, BD00948614, CSC020607129, MS-7134, ST00IWPI, TX00IWEE, Y3482678
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.32
- Heavy atoms count
- 23
- Rotatable bond count
- 3
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.055
- Polar surface area (Å)
- 83
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
![Chemical structure of 2-{[(1,3-dioxo-2,3-dihydro-1H-inden-2-ylidene)methyl]amino}-5-methylbenzoic acid (C18H13NO4) - CSSB00020607129](/st/structure/200/b2b4f77c31ddc6485567f1ac8e97d27d/CC1%253DCC%253DC%2528NC%253DC2C%2528%253DO%2529C3%253DCC%253DCC%253DC3C2%253DO%2529C%2528%253DC1%2529C%2528O%2529%253DO.png "C18H13NO4")
- Zoom the structure
- CSSB00020607129
Items Overall 4 items from 2 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Key Organics Limited (BIONET) | 10 days | United Kingdom To: | 90 | 500 mg | 566.50 | |
| 1st Scientific LLC | 14 days | United States To: | 90 | 1 mg | 221.10 | |
| 1st Scientific LLC | 14 days | United States To: | 90 | 5 mg | 235.40 | |
| 1st Scientific LLC | 14 days | United States To: | 90 | 10 mg | 264.00 | |
Description: 2-{[(1,3-dioxo-2,3-dihydro-1H-inden-2-ylidene)methyl]amino}-5-methylbenzoic acid; CAS: 959579-16-9 | ||||||
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