Cas no 1459773-19-3 ((1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol)
(1S)-1-(5-Bromopyrimidin-2-yl)ethan-1-ol is a chiral brominated pyrimidine derivative with significant utility in pharmaceutical and agrochemical synthesis. Its stereospecific (S)-configuration ensures high enantioselectivity, making it valuable for asymmetric synthesis and chiral intermediate applications. The bromine substituent at the 5-position enhances reactivity for further functionalization, such as cross-coupling reactions (e.g., Suzuki or Buchwald-Hartwig). The hydroxyl group provides a handle for derivatization, enabling the formation of esters, ethers, or other modified structures. This compound is particularly useful in the development of bioactive molecules, offering precise control over stereochemistry and molecular architecture. Its stability and purity make it suitable for rigorous research and industrial-scale applications.
1459773-19-3 structure
Product Name:(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol
CAS No:1459773-19-3
MF:C6H7BrN2O
MW:203.036580324173
CID:5912276
PubChem ID:86696897
Update Time:2025-10-20
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol Chemical and Physical Properties
Names and Identifiers
-
- (1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol
- (S)-1-(5-bromopyrimidin-2-yl)ethanol
- SCHEMBL15260235
- XTAKQONFXDJSHA-BYPYZUCNSA-N
- (1S)-1-(5-bromopyrimidin-2-yl)ethanol
- 1459773-19-3
- EN300-1911344
- 2-Pyrimidinemethanol, 5-bromo-α-methyl-, (αS)-
-
- Inchi： 1S/C6H7BrN2O/c1-4(10)6-8-2-5(7)3-9-6/h2-4,10H,1H3/t4-/m0/s1
- InChI Key： XTAKQONFXDJSHA-BYPYZUCNSA-N
- SMILES： C1([C@H](C)O)=NC=C(Br)C=N1
Computed Properties
- Exact Mass: 201.97418g/mol
- Monoisotopic Mass: 201.97418g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 104
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.4
- Topological Polar Surface Area: 46?2
Experimental Properties
- Density: 1.648±0.06 g/cm3(Predicted)
- Boiling Point: 256.7±20.0 °C(Predicted)
- pka: 13.29±0.20(Predicted)
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-1911344-0.05g |
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol |
1459773-19-3 | 0.05g |
$1779.0 | 2023-09-17 | ||
| Enamine | EN300-1911344-0.1g |
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol |
1459773-19-3 | 0.1g |
$1863.0 | 2023-09-17 | ||
| Enamine | EN300-1911344-0.25g |
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol |
1459773-19-3 | 0.25g |
$1948.0 | 2023-09-17 | ||
| Enamine | EN300-1911344-0.5g |
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol |
1459773-19-3 | 0.5g |
$2033.0 | 2023-09-17 | ||
| Enamine | EN300-1911344-1.0g |
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol |
1459773-19-3 | 1g |
$2118.0 | 2023-05-31 | ||
| Enamine | EN300-1911344-2.5g |
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol |
1459773-19-3 | 2.5g |
$4150.0 | 2023-09-17 | ||
| Enamine | EN300-1911344-5.0g |
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol |
1459773-19-3 | 5g |
$6140.0 | 2023-05-31 | ||
| Enamine | EN300-1911344-10.0g |
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol |
1459773-19-3 | 10g |
$9105.0 | 2023-05-31 | ||
| Enamine | EN300-1911344-1g |
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol |
1459773-19-3 | 1g |
$2118.0 | 2023-09-17 | ||
| Enamine | EN300-1911344-5g |
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol |
1459773-19-3 | 5g |
$6140.0 | 2023-09-17 |
(1S)-1-(5-bromopyrimidin-2-yl)ethan-1-ol Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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