Methyl 4-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]benzoate
Structure Info
- Chemspace ID
- CSSB00000389514 (In-Stock Building Blocks)
- CAS
- 406470-74-4
- MFCD
- MFCD03303115, MFCD03303115
- IUPAC Name
- methyl 4-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]benzoate
- Mol formula
- C11H10N4O4
- Mol weight
- 262 Da
- Catalog Number(s)
- AA00JECS, AG230616, AGN-PC-0WB9JU, B016140, BB046131, BB05-1573, BBL037873, BBV-32028305, BD495167, BVV-820763150, CD11127916, CS-0240558, CSC000389514, CSCR00027794127, EN300-229000, GRA47074, HY-W179469, IBS-E0139275, JH879207, OSSL_013047, PB57004309, PBMR179213, ST00JFWC, STK298487, STOCK3S-24578, TX00JFL8, UZI/1711088, Y3578225, Z56926841, ZXT056590, s_1458_13469052_483916, s_1458____13469052____483916
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.06
- Heavy atoms count
- 19
- Rotatable bond count
- 5
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.181
- Polar surface area (Å)
- 100
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 0
![Chemical structure of Methyl 4-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]benzoate (C11H10N4O4) - CSSB00000389514](/st/structure/200/5ad6b1deccca05c54e110a5fe3d3e1ea/COC%2528%253DO%2529C1%253DCC%253DC%2528CN2C%253DNC%2528%253DN2%2529%255BN%252B%255D%2528%255BO-%255D%2529%253DO%2529C%253DC1.png "C11H10N4O4")
- Zoom the structure
- CSSB00000389514
Items Overall 8 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 52.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 78.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 110.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 174.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 224.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 477.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 898.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 1,741.00 |
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