(2-Chlorothiazol-5-yl)methanamine - CAS 120740-08-1
Catalog: |
BB004956 |
Product Name: |
(2-Chlorothiazol-5-yl)methanamine |
CAS: |
120740-08-1 |
Synonyms: |
2-Chloro-5-(aminomethyl)thiazole; 2-Chloro-5-thiazolemethanamine; 2-Chloro-5-thiazolemethylamine; 5-(Aminomethyl)-2-chlorothiazole |
Related CAS: | 153471-67-1 (hydrochloride)
|
IUPAC Name: | (2-chloro-1,3-thiazol-5-yl)methanamine |
Description: | (2-Chlorothiazol-5-yl)methanamine is a metabolite of thiamethoxam, which is a neonicotinoid insecticide. |
Molecular Weight: | 148.61 |
Molecular Formula: | C4H5ClN2S |
Canonical SMILES: | C1=C(SC(=N1)Cl)CN |
InChI: | InChI=1S/C4H5ClN2S/c5-4-7-2-3(1-6)8-4/h2H,1,6H2 |
InChI Key: | KCDQBIMJBRASQE-UHFFFAOYSA-N |
Boiling Point: | 274.7±32.0°C (Predicted) |
Melting Point: | 121°C |
Purity: | ≥95% |
Density: | 1.427±0.06 g/cm3(Predicted) |
Solubility: | Soluble in Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Colourless to Yellow Oily Matter |
Storage: | Store at 2-8°C under inert atmosphere |
MDL: | MFCD08705904 |
LogP: | 1.95550 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P260, P264, P270, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112225710-A | Sulfone-containing heterocyclic derivatives, and preparation method and application thereof | 20201014 |
CN-110835325-A | Method for treating and recycling clothianidin production wastewater | 20180815 |
CN-110294751-B | Imidazo [4,5-b ] pyridine compound with biological activity and preparation method and application thereof | 20180321 |
AU-2018223435-A1 | Tri-cycle compound and applications thereof | 20170223 |
AU-2017326356-A1 | Hepatitis B core protein modulators | 20160915 |
Complexity: | 80.4 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 147.9861970 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 147.9861970 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 67.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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Amines and Anilines
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