P-Tolyl N-(3,4-dichlorophenyl)carbamate
Basic information
- CAS
2204-74-2- Standard SMILES
Cc1ccc(OC(=O)Nc2ccc(Cl)c(Cl)c2)cc1- InChIKey
YGOZWJLOFNGIEV-UHFFFAOYSA-N- Molecular formula
- C14H11Cl2NO2
- Average molar mass
- 296.1 g/mol
- Monoisotopic mass
- 295.016684
Names & identifiers
- Preferred name
- P-Tolyl N-(3,4-dichlorophenyl)carbamate
- IUPAC
- (4-methylphenyl) N-(3,4-dichlorophenyl)carbamate
- English name
- p-Tolyl N-(3,4-dichlorophenyl)carbamate
- Molecular formula
- C14H11Cl2NO2
- Molecular weight
- 296.15
Names & synonyms
2204-74-2p-tolyl n-(3,4-dichlorophenyl)carbamateRefChem:858237668-641-4p-Tolyl (3,4-dichlorophenyl)carbamate4-methylphenyl (3,4-dichlorophenyl)carbamate(4-methylphenyl) N-(3,4-dichlorophenyl)carbamateSCHEMBL21729913STL327825AKOS0221310994-methylphenyl 3,4-dichlorophenylcarbamateCarbamic acid, (3,4-dichlorophenyl)-, 4-methylphenyl ester (9CI)
Database identifiers
- CAS
2204-74-2- PubChem CID
- 853863
- EC Number
- 668-641-4
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 306
Physicochemical properties
- Melting point
- 138 · 138-140 °C
- Boiling point
- 387.5 · 387.5±42.0 °C(Predicted)
- Density
- 1.38 · 1.380±0.06 g/cm3(Predicted)
- pka
- 11.61 · 11.61±0.70(Predicted)
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 410 · H410
- Precautionary statements
- 273 · P273-P391-P501
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
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, 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 CategoriesAquatic Acute 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- Hazard statements
- H410
- Precautionary statements
- P273-P391-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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