N-(1-((Anilinocarbothioyl)amino)-2,2,2-trichloroethyl)-5-bromo-2-furamide
Basic information
- CAS
303061-96-3- Standard SMILES
O=C(NC(NC(=S)Nc1ccccc1)C(Cl)(Cl)Cl)c1ccc(Br)o1- InChIKey
GTJIFPKPFXZTAY-UHFFFAOYSA-N- Molecular formula
- C14H11BrCl3N3O2S
- Average molar mass
- 471.6 g/mol
- Monoisotopic mass
- 468.88209
Names & identifiers
- Preferred name
- N-(1-((Anilinocarbothioyl)amino)-2,2,2-trichloroethyl)-5-bromo-2-furamide
- IUPAC
- 5-bromo-N-[2,2,2-trichloro-1-(phenylcarbamothioylamino)ethyl]furan-2-carboxamide
- English name
- 5-bromo-N-{2,2,2-trichloro-1-[(phenylcarbamothioyl)amino]ethyl}furan-2-carboxamide
- Molecular formula
- C14H11BrCl3N3O2S
- Molecular weight
- 471.58
Names & synonyms
303061-96-3N-(1-((ANILINOCARBOTHIOYL)AMINO)-2,2,2-TRICHLOROETHYL)-5-BROMO-2-FURAMIDERefChem:823441662-149-35-Bromo-N-(2,2,2-trichloro-1-(3-phenylthioureido)ethyl)furan-2-carboxamideAKOS0244240515-bromo-N-{2,2,2-trichloro-1-[(phenylcarbamothioyl)amino]ethyl}furan-2-carboxamide2-Furancarboxamide, 5-bromo-N-[2,2,2-trichloro-1-[[(phenylamino)thioxomethyl]amino]ethyl]-
Database identifiers
- CAS
303061-96-3- PubChem CID
- 4337012
- EC Number
- 662-149-3
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 98.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 461
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315-H413
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H315-H413
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Suppliers
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Related reactions
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Compound notes
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