2-(Chloromethyl)thiazole Hydrochloride - CAS 71670-79-6
Catalog: |
BB034446 |
Product Name: |
2-(Chloromethyl)thiazole Hydrochloride |
CAS: |
71670-79-6 |
Synonyms: |
2-(chloromethyl)thiazole;hydrochloride; 2-(chloromethyl)-1,3-thiazole;hydrochloride |
IUPAC Name: | 2-(chloromethyl)-1,3-thiazole;hydrochloride |
Description: | 2-(Chloromethyl)thiazole Hydrochloride (CAS# 71670-79-6) is a useful research chemical. |
Molecular Weight: | 170.06 |
Molecular Formula: | C4H5Cl2NS |
Canonical SMILES: | C1=CSC(=N1)CCl.Cl |
InChI: | InChI=1S/C4H4ClNS.ClH/c5-3-4-6-1-2-7-4;/h1-2H,3H2;1H |
InChI Key: | ICKMSJLWRQTIFI-UHFFFAOYSA-N |
LogP: | 2.68390 |
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 |
US-2020223840-A1 | Substituted pyrrolidine amides iii | 20190111 |
WO-2020144375-A1 | Substituted pyrrolidine amides iii | 20190111 |
WO-2020144375-A9 | Substituted pyrrolidine amides iii | 20190111 |
TW-202043211-A | Substituted pyrrolidine amides iii | 20190111 |
CN-113382990-A | Substituted pyrrolidine amides III | 20190111 |
Complexity: | 59.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 168.9519757 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 168.9519757 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 41.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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