2-chloro-N-(1,3-thiazol-2-yl)acetamide
Basic information
- CAS
5448-49-7- Standard SMILES
O=C(CCl)Nc1nccs1- InChIKey
LSDJRBFOXKCGFY-UHFFFAOYSA-N- Molecular formula
- C5H5ClN2OS
- Average molar mass
- 176.62 g/mol
- Monoisotopic mass
- 175.98111146
Names & identifiers
- Preferred name
- 2-chloro-N-(1,3-thiazol-2-yl)acetamide
- IUPAC
- 2-chloro-N-(1,3-thiazol-2-yl)acetamide
- English name
- 2-Chloro-N-(1,3-thiazol-2-yl)acetamide
- Molecular formula
- C5H5ClN2OS
- Molecular weight
- 176.62
Names & synonyms
2-Chloro-N-(1,3-thiazol-2-yl)acetamideDTXSID20280640RefChem:469910DTXCID80231794978-787-35448-49-72-Chloro-N-thiazol-2-yl-acetamide2-chloro-N-1,3-thiazol-2-ylacetamide2-chloro-N-(thiazol-2-yl)acetamideMFCD004663962-chloro-n-(2-thiazolyl)acetamideMLS000718571
Show more names
NSC 178242-chloro-N-(1,3-thiazol-2-yl)ethanamideJR-8656, 2-Chloro-N-1,3-thiazol-2-ylacetamide, 97%2-chloro-N-1,3-thiazol-2-ylacetamide(SALTDATA: FREE)2-Chloro-N-thiazol-2-yl-acetaMide, 98+% C5H5ClN2OS, MW: 176.63
Acetamide, 2-chloro-N-(2-thiazolyl)-SMR0002908392-Chloroacetamidothiazole2-(2-Chloroacetamido)thiazolecid_226883SCHEMBL1358344SCHEMBL4797356CHEMBL1470679
Database identifiers
- CAS
5448-49-7- PubChem CID
- 226883
- DTXSID
DTXSID20280640- ChEMBL
CHEMBL1470679- EC Number
- 978-787-3
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 133
Experimental & physicochemical properties
Solubility>26.5 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Melting point
- 162 · 162-164℃
- Density
- 1.514 · 1.514
- storage temp.
- 2 · 2-8°C
- Appearance
- Off-white to light brown Solid
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 280 · P280-P271-P261-P264-P304-P340-P312-P302-P352-P362-2-P363-P332-P313-P305-P351-P338-P337-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P280-P271-P261-P264-P304-P340-P312-P302-P352-P362-2-P363-P332-P313-P305-P351-P338-P337-P405-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
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Compound notes
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