1,2-Thiazol-5-ylmethanamine Hydrochloride - CAS 2095410-14-1
Catalog: |
BB057404 |
Product Name: |
1,2-Thiazol-5-ylmethanamine Hydrochloride |
CAS: |
2095410-14-1 |
Synonyms: |
isothiazol-5-ylmethanamine-hydrogen chloride |
IUPAC Name: | 1,2-thiazol-5-ylmethanaminehydrochloride |
Description: | 1,2-Thiazol-5-ylmethanamine Hydrochloride may be useful in the preparation of heterocycles as cyclooxygenase-2 inhibitors and uses thereof. |
Molecular Weight: | 150.6 |
Molecular Formula: | C4H6N2S·HCl |
Canonical SMILES: | C1=C(SN=C1)CN.Cl |
InChI: | InChI=1S/C4H6N2S.ClH/c5-3-4-1-2-6-7-4/h1-2H,3,5H21H |
InChI Key: | VNUIAINVCHTMGH-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 57.7 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 150.0018471 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 150.0018471 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 67.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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