Basic information
- Standard SMILES
CCC(CCN(C)C(=O)OC(C)(C)C)Oc1cc(C(F)(F)F)ccc1Cl- InChIKey
AYLLJNZWPPXAFP-UHFFFAOYSA-N- Molecular formula
- C18H25ClF3NO3
- Average molar mass
- 395.8 g/mol
Names & identifiers
- Preferred name
- [3-[2-Chloro-5-(trifluoromethyl)phenoxy]pentyl]methylcarbamic acid, 1,1-dimethylethyl ester
- IUPAC
- tert-butyl N-[3-[2-chloro-5-(trifluoromethyl)phenoxy]pentyl]-N-methylcarbamate
Names & synonyms
[3-[2-chloro-5-(trifluoromethyl)phenoxy]pentyl]methylcarbamic acid, 1,1-dimethylethyl ester
Database identifiers
- PubChem CID
- 91060885
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 454
Related reactions
1 records
Compound notes
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