4-Bromo-N-(2,2,2-trichloro-1-(((mesitylamino)carbothioyl)amino)ethyl)benzamide
Basic information
- CAS
303063-15-2- Standard SMILES
Cc1cc(C)c(NC(=S)NC(NC(=O)c2ccc(Br)cc2)C(Cl)(Cl)Cl)c(C)c1- InChIKey
KHGSQNQPNQCQJB-UHFFFAOYSA-N- Molecular formula
- C19H19BrCl3N3OS
- Average molar mass
- 523.7 g/mol
- Monoisotopic mass
- 520.94978
Names & identifiers
- Preferred name
- 4-Bromo-N-(2,2,2-trichloro-1-(((mesitylamino)carbothioyl)amino)ethyl)benzamide
- IUPAC
- 4-bromo-N-[2,2,2-trichloro-1-[(2,4,6-trimethylphenyl)carbamothioylamino]ethyl]benzamide
- English name
- 4-bromo-N-(2,2,2-trichloro-1-{[(2,4,6-trimethylphenyl)carbamothioyl]amino}ethyl)benzamide
- Molecular formula
- C19H19BrCl3N3OS
- Molecular weight
- 523.70166
Names & synonyms
303063-15-24-BROMO-N-(2,2,2-TRICHLORO-1-(((MESITYLAMINO)CARBOTHIOYL)AMINO)ETHYL)BENZAMIDERefChem:520416656-930-84-bromo-N-(2,2,2-trichloro-1-{[(mesitylamino)carbonothioyl]amino}ethyl)benzamideCBMicro_010395SMSF0014647AKOS002686667CB133424-bromo-N-[2,2,2-trichloro-1-[(2,4,6-trimethylphenyl)carbamothioylamino]ethyl]benzamideBIM-0010474.P0014-bromo-N-(2,2,2-trichloro-1-{[(2,4,6-trimethylphenyl)carbamothioyl]amino}ethyl)benzamide
Database identifiers
- CAS
303063-15-2- PubChem CID
- 2887399
- EC Number
- 656-930-8
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 85.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 543
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 335 · H335-H410-H319-H315
- Precautionary statements
- 273 · P273-P391-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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, P391, 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,GHS09
- Hazard statements
- H335-H410-H319-H315
- Precautionary statements
- P273-P391-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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