2-(Dimethylamino)ethanethiol hydrochloride - CAS 13242-44-9
Catalog: |
BB007586 |
Product Name: |
2-(Dimethylamino)ethanethiol hydrochloride |
CAS: |
13242-44-9 |
Synonyms: |
2-(dimethylamino)ethanethiol;hydrochloride |
IUPAC Name: | 2-(dimethylamino)ethanethiol;hydrochloride |
Description: | 2-(Dimethylamino)ethanethiol hydrochloride (CAS# 13242-44-9) is a starting material for the synthesis of Echothiophate Iodide (E325800). Echothiophate Iodide is an anticholinesterase drug. |
Molecular Weight: | 141.66 |
Molecular Formula: | C4H12ClNS |
Canonical SMILES: | CN(C)CCS.Cl |
InChI: | InChI=1S/C4H11NS.ClH/c1-5(2)3-4-6;/h6H,3-4H2,1-2H3;1H |
InChI Key: | NRVFDGZJTPCULU-UHFFFAOYSA-N |
Boiling Point: | 121.9 °C at 760 mmHg |
Melting Point: | 150-160 °C (lit.) |
Purity: | 95 % |
Appearance: | White to off-white crystalline powder |
Storage: | Refrigerator (+4 °C) |
MDL: | MFCD00012633 |
LogP: | 1.27980 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
ES-2809348-B2 | POLYMERS FOR GENE THERAPY | 20201027 |
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PMID | Publication Date | Title | Journal |
22121734 | 20110701 | Characterization of attractive interaction-driven carbon nanotube composites with Cd-based nanoparticles | Journal of nanoscience and nanotechnology |
20223676 | 20100401 | Preparation and in vitro photodynamic activity of amphiphilic zinc(II) phthalocyanines substituted with 2-(dimethylamino)ethylthio moieties and their N-alkylated derivatives | Bioorganic & medicinal chemistry |
18717546 | 20081120 | Conjugating luminescent CdTe quantum dots with biomolecules | The journal of physical chemistry. B |
Complexity: | 28.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 141.0378983 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 141.0378983 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 4.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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