Basic information
- CAS
73855-35-3- Standard SMILES
CNC(=O)Oc1c(Cl)c(C(Cl)(Cl)Cl)nc2ccccc12- InChIKey
LSZWFTSRRVKZLC-UHFFFAOYSA-N- Molecular formula
- C12H8Cl4N2O2
- Average molar mass
- 354 g/mol
- Monoisotopic mass
- 351.933988
Names & identifiers
- Preferred name
- 4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate
- IUPAC
- [3-chloro-2-(trichloromethyl)quinolin-4-yl] N-methylcarbamate
Names & synonyms
4-Quinolinol, 3-chloro-2-trichloromethyl-, methylcarbamate3-Chloro-2-trichloromethyl-4-quinolinol methylcarbamateWV24TB8S8973855-35-3NSC-2227274-Quinolinol, 3-chloro-2-(trichloromethyl)-, methylcarbamate (ester)Carbamic acid, methyl-, 3-chloro-2-(trichloromethyl)-4-quinolyl esterDTXSID20224428RefChem:1071590DTXCID20146919NSC 222727NSC222727
Show more names
3-chloro-2-(trichloromethyl)quinolin-4-yl methylcarbamateUNII-WV24TB8S894-Quinolinol, methylcarbamate4-Quinolinol, methylcarbamate (ester)Carbamic acid, 3-chloro-2-(trichloromethyl)-4-quinolyl ester
Database identifiers
- CAS
73855-35-3- PubChem CID
- 99445
- DTXSID
DTXSID20224428- UNII
- WV24TB8S89
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 364
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…