Basic information
- CAS
302913-84-4- Standard SMILES
CCCCCCCCCCCCCCCC(=O)NC(NC(=S)Nc1ccc(Cl)cc1Cl)C(Cl)(Cl)Cl- InChIKey
FTJLDFRDSDPRPM-UHFFFAOYSA-N- Molecular formula
- C25H38Cl5N3OS
- Average molar mass
- 605.9 g/mol
- Monoisotopic mass
- 603.117822
Names & identifiers
- Preferred name
- N-(2,2,2-Trichloro-1-(((2,4-dichloroanilino)carbothioyl)amino)ET)hexadecanamide
- IUPAC
- N-[2,2,2-trichloro-1-[(2,4-dichlorophenyl)carbamothioylamino]ethyl]hexadecanamide
- English name
- N-(2,2,2-trichloro-1-{[(2,4-dichlorophenyl)carbamothioyl]amino}ethyl)hexadecanamide
- Molecular formula
- C25H38Cl5N3OS
- Molecular weight
- 605.92
Names & synonyms
N-(2,2,2-TRICHLORO-1-(((2,4-DICHLOROANILINO)CARBOTHIOYL)AMINO)ET)HEXADECANAMIDERefChem:823701302913-84-4658-450-4AKOS024423843N-(2,2,2-trichloro-1-{[(2,4-dichlorophenyl)carbamothioyl]amino}ethyl)hexadecanamideHexadecanamide, N-[2,2,2-trichloro-1-[[[(2,4-dichlorophenyl)amino]thioxomethyl]amino]ethyl]-
Database identifiers
- CAS
302913-84-4- PubChem CID
- 5113612
- EC Number
- 658-450-4
Properties
Computed structural properties
- XLogP
- 11.4
- Topological polar surface area
- 85.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 17
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 594
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315
- 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, 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
- H319-H335-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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