Cas no 915923-05-6 (2-(3,5-dimethylisoxazol-4-yl)ethanethiol)
2-(3,5-Dimethylisoxazol-4-yl)ethanethiol is a sulfur-containing heterocyclic compound featuring a reactive thiol group attached to a 3,5-dimethylisoxazole scaffold. This structure imparts unique reactivity, making it valuable in organic synthesis, particularly for thiol-ene click chemistry and metal coordination applications. The isoxazole ring enhances stability while the thiol group facilitates conjugation with electrophiles, enabling the formation of stable thioether linkages. Its well-defined molecular architecture ensures consistent performance in pharmaceutical intermediates, ligand design, and material science. The compound's compatibility with a range of reaction conditions and its ability to serve as a versatile building block underscore its utility in specialized chemical synthesis.
915923-05-6 structure
Product Name:2-(3,5-dimethylisoxazol-4-yl)ethanethiol
CAS No:915923-05-6
MF:C7H11NOS
MW:157.233340501785
MDL:MFCD08060041
CID:876274
PubChem ID:25219629
Update Time:2025-05-27
2-(3,5-dimethylisoxazol-4-yl)ethanethiol Chemical and Physical Properties
Names and Identifiers
-
- 2-(3,5-dimethylisoxazol-4-yl)ethanethiol
- 2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanethiol
- 2-(3,5-Dimethyl-4-isoxazolyl)ethanethiol
- EN300-1870109
- DTXSID00649276
- 915923-05-6
- 2-(3,5-Dimethyl-1,2-oxazol-4-yl)ethane-1-thiol
- 3,5-Dimethyl-4-isoxazoleethanethiol
- 2-(3,5-Dimethylisoxazol-4-yl)ethane-1-thiol
- CHEMBRDG-BB 4016588
- AKOS000266316
- 2-(3,5-dimethylisoxazol-4-yl)ethanethiol, AldrichCPR
- FT-0679254
- MFCD08060041
- 2-(dimethyl-1,2-oxazol-4-yl)ethane-1-thiol
- CS-0282915
- LS-02402
-
- MDL： MFCD08060041
- Inchi： 1S/C7H11NOS/c1-5-7(3-4-10)6(2)9-8-5/h10H,3-4H2,1-2H3
- InChI Key： YCAOLMCCUVXXJA-UHFFFAOYSA-N
- SMILES： SCCC1C(C)=NOC=1C
Computed Properties
- Exact Mass: 157.05600
- Monoisotopic Mass: 157.056
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 110
- 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
- Topological Polar Surface Area: 27A^2
- XLogP3: 1.7
Experimental Properties
- Density: 1.1±0.1 g/cm3
- Boiling Point: 269.2±28.0 °C at 760 mmHg
- Flash Point: 116.6±24.0 °C
- Refractive Index: 1.515
- PSA: 64.83000
- LogP: 1.76370
- Vapor Pressure: 0.0±0.5 mmHg at 25°C
2-(3,5-dimethylisoxazol-4-yl)ethanethiol Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Hazard Category Code： 36
- Safety Instruction： 26
-
Hazardous Material Identification：
- HazardClass：IRRITANT
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
2-(3,5-dimethylisoxazol-4-yl)ethanethiol Customs Data
- HS CODE：2934999090
- Customs Data：
China Customs Code:
2934999090Overview:
2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to
Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
2-(3,5-dimethylisoxazol-4-yl)ethanethiol Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 043691-250mg |
2-(3,5-Dimethyl-4-isoxazolyl)ethanethiol |
915923-05-6 | 95% | 250mg |
￡17.00 | 2022-03-01 | |
| Fluorochem | 043691-10g |
2-(3,5-Dimethyl-4-isoxazolyl)ethanethiol |
915923-05-6 | 95% | 10g |
￡280.00 | 2022-03-01 | |
| TRC | D478843-500mg |
2-(3,5-dimethylisoxazol-4-yl)ethanethiol |
915923-05-6 | 500mg |
$ 70.00 | 2022-06-05 | ||
| TRC | D478843-1g |
2-(3,5-dimethylisoxazol-4-yl)ethanethiol |
915923-05-6 | 1g |
$ 95.00 | 2022-06-05 | ||
| TRC | D478843-5g |
2-(3,5-dimethylisoxazol-4-yl)ethanethiol |
915923-05-6 | 5g |
$ 340.00 | 2022-06-05 | ||
| Fluorochem | 043691-5g |
2-(3,5-Dimethyl-4-isoxazolyl)ethanethiol |
915923-05-6 | 95% | 5g |
￡167.00 | 2022-03-01 | |
| Fluorochem | 043691-1g |
2-(3,5-Dimethyl-4-isoxazolyl)ethanethiol |
915923-05-6 | 95% | 1g |
￡58.00 | 2022-03-01 | |
| abcr | AB217395-1 g |
2-(3,5-Dimethyl-4-isoxazolyl)ethanethiol; 95% |
915923-05-6 | 1 g |
€94.10 | 2023-07-20 | ||
| abcr | AB217395-5 g |
2-(3,5-Dimethyl-4-isoxazolyl)ethanethiol; 95% |
915923-05-6 | 5 g |
€186.30 | 2023-07-20 | ||
| abcr | AB217395-10 g |
2-(3,5-Dimethyl-4-isoxazolyl)ethanethiol; 95% |
915923-05-6 | 10 g |
€269.00 | 2023-07-20 |
2-(3,5-dimethylisoxazol-4-yl)ethanethiol Related Literature
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
915923-05-6 (2-(3,5-dimethylisoxazol-4-yl)ethanethiol) Related Products
- 116422-98-1(3-(dimethyl-1,2-oxazol-4-yl)propanenitrile)
- 129975-10-6(3-(dimethyl-1,2-oxazol-4-yl)propan-1-ol)
- 93548-08-4(Isoxazole, 3,5-dimethyl-4-pentyl- (9CI))
- 83467-34-9(2-(3,5-Dimethylisoxazol-4-yl)ethanol)
- 83467-36-1(4-(2-Iodoethyl)-3,5-dimethylisoxazole)
- 197310-97-7(4-Isoxazoleacetonitrile,3-ethyl-5-methyl-(9CI))
- 510717-69-8(2-(3,5-dimethylisoxazol-4-yl)ethanamine)
- 771572-98-6(3-(3,5-Dimethylisoxazol-4-yl)propan-1-amine)
- 83467-32-7(Isoxazole,4-(2-methoxyethyl)-3,5-dimethyl-)
- 79379-02-5(4-(2-chloroethyl)-3,5-dimethylisoxazole)
Recommended suppliers
Shanghai Bent Chemical Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
Nanjing Jubai Biopharm
Gold Member
Audited Supplier
CN Supplier
Bulk
Amadis Chemical Company Limited
Gold Member
Audited Supplier
CN Supplier
Reagent
SunaTech Inc.
Gold Member
Audited Supplier
CN Supplier
Reagent
Yunnanjiuzhen
Gold Member
Audited Supplier
CN Supplier
Bulk
