2-Methyl-2-thiazoline - CAS 2346-00-1
Catalog: |
BB018067 |
Product Name: |
2-Methyl-2-thiazoline |
CAS: |
2346-00-1 |
Synonyms: |
2-methyl-4,5-dihydro-1,3-thiazole |
IUPAC Name: | 2-methyl-4,5-dihydro-1,3-thiazole |
Description: | 2-Methyl-2-thiazoline (CAS# 2346-00-1) is a useful research chemical. |
Molecular Weight: | 101.17 |
Molecular Formula: | C4H7NS |
Canonical SMILES: | CC1=NCCS1 |
InChI: | InChI=1S/C4H7NS/c1-4-5-2-3-6-4/h2-3H2,1H3 |
InChI Key: | JUIQOABNSLTJSW-UHFFFAOYSA-N |
Boiling Point: | 144-145 °C |
Melting Point: | -101 °C |
Purity: | 95 % |
Density: | 1.067 g/cm3 |
Appearance: | Colorless to orange-yellow liquid |
Storage: | 2-8 °C |
MDL: | MFCD00005314 |
LogP: | 0.58720 |
GHS Hazard Statement: | H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2015322376-A1 | Fragrance Compositions | 20140506 |
WO-2015171738-A2 | Fragrance compositions | 20140506 |
WO-2015160634-A1 | Factor ixa inhibitors | 20140416 |
WO-2015160636-A1 | Factor ixa inhibitors | 20140416 |
WO-2015096873-A1 | Beta-hairpin peptidomimetics as selective elastase inhibitors | 20131227 |
PMID | Publication Date | Title | Journal |
18831547 | 20081103 | Formation of P-C bonds under unexpectedly mild conditions. Phosphoryl migration and metal coordination of diphenylphosphinomethyl-oxazolines and -thiazolines | Inorganic chemistry |
11781463 | 20020101 | Hexa-mu-chloro-mu4-oxo-tetrakis[(4,5-dihydro-2-methyl-1,2-thiazole-kappaN)copper(II)] | Acta crystallographica. Section C, Crystal structure communications |
11714312 | 20011101 | N-heterocyclic derivatives of 2,4-dihydroxybenzcarbothioamide as antimycotic agents | Journal of agricultural and food chemistry |
Complexity: | 77.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 101.02992040 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 101.02992040 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 37.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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Related Functional Groups
Oxazole/Thiazole
Thiazolines/Thiazolidines
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