Basic information
- CAS
303091-45-4- Standard SMILES
O=C(CSCCSCC(=O)Nc1ccc(Cl)c(Cl)c1)Nc1ccc(Cl)c(Cl)c1- InChIKey
WGYIBQIPORPMML-UHFFFAOYSA-N- Molecular formula
- C18H16Cl4N2O2S2
- Average molar mass
- 498.3 g/mol
- Monoisotopic mass
- 495.940731
Names & identifiers
- Preferred name
- 2-((2-((2-(3,4-Dichloroanilino)-2-oxoethyl)sulfanyl)ethyl)sulfanyl)-N-(3,4-dichlorophenyl)acetamide
- IUPAC
- 2-[2-[2-(3,4-dichloroanilino)-2-oxoethyl]sulfanylethylsulfanyl]-N-(3,4-dichlorophenyl)acetamide
- English name
- 2-[(2-([2-(3,4-Dichloroanilino)-2-oxoethyl]sulfanyl)ethyl)sulfanyl]-N-(3,4-dichlorophenyl)acetamide
- Molecular formula
- C18H16Cl4N2O2S2
- Molecular weight
- 498.27
Names & synonyms
303091-45-42-[(2-{[2-(3,4-dichloroanilino)-2-oxoethyl]sulfanyl}ethyl)sulfanyl]-N-(3,4-dichlorophenyl)acetamide2-((2-((2-(3,4-Dichloroanilino)-2-oxoethyl)sulfanyl)ethyl)sulfanyl)-N-(3,4-dichlorophenyl)acetamideRefChem:447577652-924-42,2'-(Ethane-1,2-diylbis(sulfanediyl))bis(N-(3,4-dichlorophenyl)acetamide)2-[2-[2-(3,4-dichloroanilino)-2-oxoethyl]sulfanylethylsulfanyl]-N-(3,4-dichlorophenyl)acetamideAKOS005106209JS-1825N-(3,4-dichlorophenyl)-2-{[2-({[(3,4-dichlorophenyl)carbamoyl]methyl}sulfanyl)ethyl]sulfanyl}acetamideAcetamide, 2,2'-[1,2-ethanediylbis(thio)]bis[N-(3,4-dichlorophenyl)- (9CI)2-[(2-([2-(3,4-Dichloroanilino)-2-oxoethyl]sulfanyl)ethyl)sulfanyl]-N-(3,4-dichlorophenyl)acetamide
Database identifiers
- CAS
303091-45-4- PubChem CID
- 4099472
- EC Number
- 652-924-4
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 474
Physicochemical properties
- Boiling point
- 716.7 · 716.7±60.0 °C(Predicted)
- Density
- 1.531 · 1.531±0.06 g/cm3(Predicted)
- pka
- 11.86 · 11.86±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H413
- Precautionary statements
- 264 · 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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P273, P280, P305+P351+P338, P337+P317, 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 CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H413
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers4 total
Ryan Scientific, Inc.[email protected]
Key Organics Ltd.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
BIONET-INTER[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…