2-methyl-3,5-dinitro-4-[(pentan-3-yl)amino]benzoic acid
Structure Info
- Chemspace ID
- CSSB00102514965 (In-Stock Building Blocks)
- CAS
- 127971-53-3
- MFCD
- MFCD01661407
- IUPAC Name
- 2-methyl-3,5-dinitro-4-[(pentan-3-yl)amino]benzoic acid
- Mol formula
- C13H17N3O6
- Mol weight
- 311 Da
- Catalog Number(s)
- AA000XIW, AA43348, AG000XLO, AI43348, AOS000XLO, AR000YAO, AS-70940, ArZ-UP151978, ArZ-UP198668, B699375, BB4LS-EN300-370782, BBLS00102514965, CFA97153, CSC102514965, D761154, D77971, D77971-0.1G, D77971-0.25G, E926350, EBC-217023, EC000ZRG, EN300-370782, F808578, LN03288694, OR1134917, PBSY668, ST000Z2G, TX000YRC, V144062, Z2753226759, ZX-NM241943, ZXC121101, bbls00102514965
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.97
- Heavy atoms count
- 22
- Rotatable bond count
- 7
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.461
- Polar surface area (Å)
- 136
- Hydrogen bond acceptors count
- 7
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSSB00102514965
Items Overall 60 items from 17 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BB4LS US | 2 days | United States To: | 95 | 50 umol | 93.57 | |
| BB4LS US | 2 days | United States To: | 95 | 100 umol | 128.36 | |
| BB4LS US | 2 days | United States To: | 95 | 200 umol | 180.00 | |
| BB4LS US | 2 days | United States To: | 95 | 300 umol | 226.00 | |
| BB4LS US | 2 days | United States To: | 95 | 500 umol | 279.00 | |
| Astatech CN | 2 days | China To: | 95 | 100 mg | 126.50 | |
| Astatech CN | 2 days | China To: | 95 | 250 mg | 207.90 | |
| Astatech CN | 2 days | China To: | 95 | 1 g | 617.10 | |
Description: 2-METHYL-3,5-DINITRO-4-[(PENTAN-3-YL)AMINO]BENZOIC ACID; CAS: 127971-53-3 | ||||||
| Astatech Inc | 2 days | United States To: | 95 | 100 mg | 126.50 | |
| Astatech Inc | 2 days | United States To: | 95 | 250 mg | 207.90 | |
| Astatech Inc | 2 days | United States To: | 95 | 1 g | 617.10 | |
Description: 2-METHYL-3,5-DINITRO-4-[(PENTAN-3-YL)AMINO]BENZOIC ACID; CAS: 127971-53-3 | ||||||
| 1st Scientific CN | 3 days | China To: | 95 | 100 mg | 126.50 | |
| 1st Scientific CN | 3 days | China To: | 95 | 250 mg | 207.90 | |
| 1st Scientific CN | 3 days | China To: | 95 | 1 g | 639.10 | |
Description: 4-[(1-Ethylpropyl)amino]-2-methyl-3,5-dinitrobenzoic acid; CAS: 127971-53-3 | ||||||
| 1st Scientific LLC | 3 days | United States To: | 95 | 100 mg | 126.50 | |
| 1st Scientific LLC | 3 days | United States To: | 95 | 250 mg | 207.90 | |
| 1st Scientific LLC | 3 days | United States To: | 95 | 1 g | 639.10 | |
Description: 4-[(1-Ethylpropyl)amino]-2-methyl-3,5-dinitrobenzoic acid; CAS: 127971-53-3 | ||||||
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 155.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 232.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 331.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 524.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 671.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 1,315.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 1,945.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 10 g | 2,884.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 155.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 232.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 331.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 524.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 671.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 2.5 g | 1,315.00 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 50 umol | 93.57 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 100 umol | 128.36 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 200 umol | 180.00 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 300 umol | 226.00 | |
| BB4LS EU | 7 days | Latvia To: | 95 | 500 umol | 279.00 | |
| Angene International Limited | 10 days | China To: | 95 | 100 mg | 80.10 | |
| Angene International Limited | 10 days | China To: | 95 | 250 mg | 131.40 | |
| Angene International Limited | 10 days | China To: | 95 | 1 g | 389.70 | |
Description: 4-[(1-Ethylpropyl)amino]-2-methyl-3,5-dinitrobenzoic acid; CAS: 127971-53-3 | ||||||
| Advanced ChemBlocks CN | 10 days | China To: | 95 | 250 mg | 210.00 | |
| Advanced ChemBlocks CN | 10 days | China To: | 95 | 1 g | 625.00 | |
Description: Benzoic acid, 4-[(1-ethylpropyl)amino]-2-methyl-3,5-dinitro-; CAS: 127971-53-3 | ||||||
| Key Organics Limited (BIONET) | 10 days | United Kingdom To: | 95 | 100 mg | 234.30 | |
| Key Organics Limited (BIONET) | 10 days | United Kingdom To: | 95 | 250 mg | 343.20 | |
| Aaron Chemicals LLC | 12 days | United States To: | 95 | 100 mg | 113.85 | |
| Aaron Chemicals LLC | 12 days | United States To: | 95 | 250 mg | 188.60 | |
| Aaron Chemicals LLC | 12 days | United States To: | 95 | 1 g | 564.65 | |
| AA BLOCKS | 12 days | United States To: | 95 | 100 mg | 140.80 | |
| AA BLOCKS | 12 days | United States To: | 95 | 250 mg | 231.00 | |
| AA BLOCKS | 12 days | United States To: | 95 | 1 g | 710.60 | |
Description: 4-[(1-Ethylpropyl)amino]-2-methyl-3,5-dinitrobenzoic acid; CAS: 127971-53-3 | ||||||
| A2B Chem | 12 days | United States To: | 95 | 100 mg | 147.20 | |
| A2B Chem | 12 days | United States To: | 95 | 250 mg | 241.50 | |
| A2B Chem | 12 days | United States To: | 95 | 1 g | 742.90 | |
Description: 4-[(1-Ethylpropyl)amino]-2-methyl-3,5-dinitrobenzoic acid; CAS: 127971-53-3 | ||||||
| Fluorochem CN | 14 days | China To: | 95 | 100 mg | 166.00 | |
| Fluorochem CN | 14 days | China To: | 95 | 250 mg | 271.00 | |
| Fluorochem CN | 14 days | China To: | 95 | 1 g | 782.00 | |
Description: 2-METHYL-3,5-DINITRO-4-[(PENTAN-3-YL)AMINO]BENZOIC ACID; ; Storage Conditions: ambient storage; Hazard Codes: H302, H315, H319, H335; GHS Pictograms: GHS07; CAS: 127971-53-3 | ||||||
| Accel Scientific, S.L. | 20 days | China To: | 95 | 100 mg | 143.00 | |
| Accel Scientific, S.L. | 20 days | China To: | 95 | 250 mg | 235.40 | |
| Accel Scientific, S.L. | 20 days | China To: | 95 | 1 g | 700.70 | |
Description: 4-[(1-Ethylpropyl)amino]-2-methyl-3,5-dinitrobenzoic acid; CAS: 127971-53-3 | ||||||
| 10X CHEM | TBD | United States To: | 95 | 100 mg | 125.40 | |
| 10X CHEM | TBD | United States To: | 95 | 250 mg | 206.80 | |
Description: 4-[(1-Ethylpropyl)amino]-2-methyl-3,5-dinitrobenzoic acid; CAS: 127971-53-3 | ||||||
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![Chemical structure of {2-methyl-3,5-dinitro-4-[(pentan-3-yl)amino]phenyl}methanol - CSSB00121571173](/st/structure/200/151405965ab1e28a68fe664457e35e89/CCC%2528CC%2529NC1%253DC%2528C%253DC%2528CO%2529C%2528C%2529%253DC1%255BN%252B%255D%2528%255BO-%255D%2529%253DO%2529%255BN%252B%255D%2528%255BO-%255D%2529%253DO.png)




