Basic information
- Standard SMILES
CC(C)(C)OC(=O)Nc1cc(Cl)c(C(F)(F)F)cc1N- InChIKey
KXLAIFIPGIZAJM-UHFFFAOYSA-N- Molecular formula
- C12H14ClF3N2O2
- Average molar mass
- 310.7 g/mol
Names & identifiers
- Preferred name
- (2-Amino-5-chloro-4-trifluoromethyl-phenyl)-carbamic acid tert-butyl ester
- IUPAC
- tert-butyl N-[2-amino-5-chloro-4-(trifluoromethyl)phenyl]carbamate
Names & synonyms
(2-Amino-5-chloro-4-trifluoromethyl-phenyl)-carbamic acid tert-butyl ester473537-78-9SCHEMBL5563662SCHEMBL29430822DB-189109Tert-butyl 2-amino-5-chloro-4-(trifluoromethyl)phenylcarbamate
Database identifiers
- PubChem CID
- 69489727
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 358
Related reactions
32 records
Linked notes
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