Carbanilic acid, 3,4-dichloro-, 5-chloro-8-quinolyl ester
Basic information
- CAS
21617-26-5- Standard SMILES
O=C(Nc1ccc(Cl)c(Cl)c1)Oc1ccc(Cl)c2cccnc12- InChIKey
ZOTDPZFBAABIEJ-UHFFFAOYSA-N- Molecular formula
- C16H9Cl3N2O2
- Average molar mass
- 367.6 g/mol
- Monoisotopic mass
- 365.972961
Names & identifiers
- Preferred name
- Carbanilic acid, 3,4-dichloro-, 5-chloro-8-quinolyl ester
- IUPAC
- (5-chloroquinolin-8-yl) N-(3,4-dichlorophenyl)carbamate
- English name
- 5-chloroquinolin-8-yl N-(3,4-dichlorophenyl)carbamate
- Molecular formula
- C16H9Cl3N2O2
- Molecular weight
- 367.61386
Names & synonyms
21617-26-5Carbanilic acid, 3,4-dichloro-, 5-chloro-8-quinolyl esterRefChem:3329555-Chloroquinolin-8-yl (3,4-dichlorophenyl)carbamate5-chloro-8-quinolinyl 3,4-dichlorophenylcarbamateDTXSID501196910AKOS0244310545-CHLORO-8-QUINOLYL N-(3,4-DICHLOROPHENYL)CARBAMATE5-chloroquinolin-8-yl N-(3,4-dichlorophenyl)carbamate
Database identifiers
- CAS
21617-26-5- PubChem CID
- 4072205
- DTXSID
DTXSID501196910- EC Number
- 667-421-5
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 426
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 413 · H413-H319
- 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
- H413-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…