4,5-Dichloroisothiazole-3-carboxylic acid
Completing data — refresh the page later to see the latest
Basic information
- CAS
131947-13-2- Standard SMILES
O=C(O)c1nsc(Cl)c1Cl- InChIKey
ZFEHQZVNKOESSZ-UHFFFAOYSA-N- Molecular formula
- C4HCl2NO2S
- Average molar mass
- 198.03 g/mol
- Monoisotopic mass
- 196.91050463
Names & identifiers
- Preferred name
- 4,5-Dichloroisothiazole-3-carboxylic acid
- IUPAC
- 4,5-Dichloro-1,2-thiazole-3-carboxylic acid
- English name
- 4,5-DICHLOROISOTHIAZOLE-3-CARBOXYLIC ACID
- Molecular formula
- C4HCl2NO2S
- Molecular weight
- 198.03
Names & synonyms
TIMTEC-BB SBB0003694,5-dichloro-isothiazol-3-carboxylic acid4,5-DICHLOROISOTHIAZOLE-3-CARBOXYLIC ACID4,5-Dichloro-3-isothiazolecarboxylic acid3-Isothiazolecarboxylic acid, 4,5-dichloro-
Database identifiers
- CAS
131947-13-2- PubChem CID
- 1244565
- DTXSID
DTXSID00361340- ChEMBL
CHEMBL1893959- EC Number
- 673-631-8
- Nikkaji
- J1.790.963K
Properties
Physicochemical properties
- Melting point
- 169 °C · 169 °C
- Boiling point
- 205.9 · 205.9±40.0 °C(Predicted)
- Density
- 1.824 · 1.824±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- form
- crystalline powder
- pka
- 1.79 · 1.79±0.25(Predicted)
- color
- White
- CAS DataBase Reference
- 131947 · 131947-13-2
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H315-H319-H332-H335
- Precautionary statements
- 233 · P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P322-P330-P332+P313-P337+P313-P340-P362-P363-P403-P403+P233-P405-P501
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
- HS Code
- 2934100090 · 2934100090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2934100090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H312-H315-H319-H332-H335
- Precautionary statements
- P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P322-P330-P332+P313-P337+P313-P340-P362-P363-P403-P403+P233-P405-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…