Cas no 1566874-44-9 (4-Chloro-2-[3-(Hydroxymethyl)pyrrolidin-1-yl]-1,3-thiazole-5-carbaldehyde)
![4-Chloro-2-[3-(Hydroxymethyl)pyrrolidin-1-yl]-1,3-thiazole-5-carbaldehyde structure](https://ossimg.kuujia.com/scimg/1567000/1566874-44-9x500.png)
1566874-44-9 structure
Product Name:4-Chloro-2-[3-(Hydroxymethyl)pyrrolidin-1-yl]-1,3-thiazole-5-carbaldehyde
CAS No:1566874-44-9
MF:C9H11ClN2O2S
MW:246.713839769363
CID:5702605
PubChem ID:112626054
Update Time:2023-10-15
4-Chloro-2-[3-(Hydroxymethyl)pyrrolidin-1-yl]-1,3-thiazole-5-carbaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 1566874-44-9
- 4-CHLORO-2-[3-(HYDROXYMETHYL)PYRROLIDIN-1-YL]-1,3-THIAZOLE-5-CARBALDEHYDE
- EN300-725439
- CID 112626054
- 5-Thiazolecarboxaldehyde, 4-chloro-2-[3-(hydroxymethyl)-1-pyrrolidinyl]-
- 4-Chloro-2-[3-(Hydroxymethyl)pyrrolidin-1-yl]-1,3-thiazole-5-carbaldehyde
-
- Inchi： 1S/C9H11ClN2O2S/c10-8-7(5-14)15-9(11-8)12-2-1-6(3-12)4-13/h5-6,13H,1-4H2
- InChI Key： YVVGGPMPQWLMIL-UHFFFAOYSA-N
- SMILES： ClC1=C(C=O)SC(=N1)N1CCC(CO)C1
Computed Properties
- Exact Mass: 246.0229765g/mol
- Monoisotopic Mass: 246.0229765g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 244
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.9
- Topological Polar Surface Area: 81.7?2
Experimental Properties
- Density: 1.461±0.06 g/cm3(Predicted)
- Boiling Point: 423.0±48.0 °C(Predicted)
- pka: 14.93±0.10(Predicted)
4-Chloro-2-[3-(Hydroxymethyl)pyrrolidin-1-yl]-1,3-thiazole-5-carbaldehyde Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-725439-1.0g |
4-chloro-2-[3-(hydroxymethyl)pyrrolidin-1-yl]-1,3-thiazole-5-carbaldehyde |
1566874-44-9 | 1g |
$0.0 | 2023-06-06 |
4-Chloro-2-[3-(Hydroxymethyl)pyrrolidin-1-yl]-1,3-thiazole-5-carbaldehyde Related Literature
-
Jason Wan Lab Chip, 2020,20, 4528-4538
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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