4-(Chloromethyl)-2-methylthiazole Hydrochloride - CAS 77470-53-2
Catalog: |
BB035957 |
Product Name: |
4-(Chloromethyl)-2-methylthiazole Hydrochloride |
CAS: |
77470-53-2 |
Synonyms: |
4-(chloromethyl)-2-methylthiazole;hydrochloride; 4-(chloromethyl)-2-methyl-1,3-thiazole;hydrochloride |
IUPAC Name: | 4-(chloromethyl)-2-methyl-1,3-thiazole;hydrochloride |
Description: | 4-(Chloromethyl)-2-methylthiazole Hydrochloride (CAS# 77470-53-2) is a compound useful in organic synthesis. |
Molecular Weight: | 184.09 |
Molecular Formula: | C5H7Cl2NS |
Canonical SMILES: | CC1=NC(=CS1)CCl.Cl |
InChI: | InChI=1S/C5H6ClNS.ClH/c1-4-7-5(2-6)3-8-4;/h3H,2H2,1H3;1H |
InChI Key: | YGKDISJLDVGNOR-UHFFFAOYSA-N |
Boiling Point: | 217.5 °C at 760 mmHg |
MDL: | MFCD00067725 |
LogP: | 2.99230 |
Publication Number | Title | Priority Date |
JP-2021102590-A | Hypoxanthine compound | 20191226 |
AU-2018233402-A1 | Pyrimidinyl-pyridyloxy-naphthyl compounds and methods of treating ire1-related diseases and disorders | 20170317 |
CN-111247136-A | Pyrimidinyl-pyridyloxy-naphthyl compounds and methods of treating diseases and disorders associated with IRE1 | 20170317 |
EP-3596063-A1 | Pyrimidinyl-pyridyloxy-naphthyl compounds and methods of treating ire1-related diseases and disorders | 20170317 |
JP-2020514377-A | Pyrimidinyl-pyridyloxy-naphthyl compounds and methods of treating IRE1-related diseases and disorders | 20170317 |
Complexity: | 78.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 182.9676258 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 182.9676258 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 41.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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