Cas no 1138444-13-9 (tert-Butyl 3-hydroxy-5-methoxyisonicotinate)
Tert-Butyl 3-hydroxy-5-methoxyisonicotinate is a versatile intermediate in organic synthesis, particularly valuable for pharmaceutical and agrochemical applications. Its structure features both hydroxyl and methoxy functional groups on a pyridine core, enabling selective modifications for complex molecule construction. The tert-butyl ester group enhances solubility in organic solvents and facilitates deprotection under mild conditions. This compound is useful in the synthesis of bioactive molecules, offering a balance of reactivity and stability. Its high purity and well-defined chemical properties make it a reliable building block for researchers developing novel compounds in medicinal chemistry and material science.
1138444-13-9 structure
Product Name:tert-Butyl 3-hydroxy-5-methoxyisonicotinate
CAS No:1138444-13-9
MF:C11H15NO4
MW:225.241103410721
CID:1072870
PubChem ID:329771554
Update Time:2025-06-08
tert-Butyl 3-hydroxy-5-methoxyisonicotinate Chemical and Physical Properties
Names and Identifiers
-
- tert-Butyl 3-hydroxy-5-methoxyisonicotinate
- A-5992
- AC1Q4F7B
- ACMC-2099k8
- AG-B-52115
- ANW-16662
- CTK7B1897
- KB-260469
- MFCD11857684
- DB-060557
- AKOS015856318
- CS-0441040
- 1138444-13-9
- tert-Butyl3-hydroxy-5-methoxyisonicotinate
- tert-Butyl 3-hydroxy-5-methoxyisonicotinate, AldrichCPR
- tert-butyl 3-hydroxy-5-methoxypyridine-4-carboxylate
- DTXSID10673865
-
- MDL： MFCD11857684
- Inchi： 1S/C11H15NO4/c1-11(2,3)16-10(14)9-7(13)5-12-6-8(9)15-4/h5-6,13H,1-4H3
- InChI Key： WTCHQCGVBIOVGX-UHFFFAOYSA-N
- SMILES： O(C(C1C(=CN=CC=1OC)O)=O)C(C)(C)C
Computed Properties
- Exact Mass: 225.10010796g/mol
- Monoisotopic Mass: 225.10010796g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 249
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.9
- Topological Polar Surface Area: 68.6?2
tert-Butyl 3-hydroxy-5-methoxyisonicotinate Security Information
- Signal Word：warning
- Hazard Statement： H303+H313+H333
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Hazardous Material transportation number：NONH for all modes of transport
- WGK Germany：3
- Safety Instruction： H303+H313+H333
- HazardClass：IRRITANT
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
tert-Butyl 3-hydroxy-5-methoxyisonicotinate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| XI GE MA AO DE LI QI （ SHANG HAI ） MAO YI Co., Ltd. | ADE000549-1G |
tert-Butyl 3-hydroxy-5-methoxyisonicotinate |
1138444-13-9 | 1g |
￥10696.47 | 2023-11-14 | ||
| TRC | B942920-10mg |
tert-Butyl 3-Hydroxy-5-methoxyisonicotinate |
1138444-13-9 | 10mg |
$ 50.00 | 2022-06-06 | ||
| TRC | B942920-50mg |
tert-Butyl 3-Hydroxy-5-methoxyisonicotinate |
1138444-13-9 | 50mg |
$ 160.00 | 2022-06-06 | ||
| TRC | B942920-100mg |
tert-Butyl 3-Hydroxy-5-methoxyisonicotinate |
1138444-13-9 | 100mg |
$ 250.00 | 2022-06-06 | ||
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | t166045-1g |
tert-Butyl 3-hydroxy-5-methoxyisonicotinate |
1138444-13-9 | 1g |
￥6,671.00 | 2021-05-24 | ||
| Chemenu | CM364074-1g |
tert-Butyl 3-hydroxy-5-methoxyisonicotinate |
1138444-13-9 | 95% | 1g |
$903 | 2022-06-14 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1511707-1g |
Tert-butyl 3-hydroxy-5-methoxyisonicotinate |
1138444-13-9 | 98% | 1g |
￥8005.00 | 2024-08-09 |
tert-Butyl 3-hydroxy-5-methoxyisonicotinate Related Literature
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
-
Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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