tert-Butyl {2-(methylsulphonyl)-1-[3-(trifluoromethyl)phenyl]ethyl}carbamate

HCID 59536720
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Basic information

Standard SMILES
CC(C)(C)OC(=O)NC(CS(C)(=O)=O)c1cccc(C(F)(F)F)c1
InChIKey
HLDYLTNJYDKDIL-UHFFFAOYSA-N
Molecular formula
C15H20F3NO4S
Average molar mass
367.4 g/mol
Monoisotopic mass
367.10651378

Names & identifiers

Preferred name
tert-Butyl {2-(methylsulphonyl)-1-[3-(trifluoromethyl)phenyl]ethyl}carbamate
IUPAC
tert-butyl N-[2-methylsulfonyl-1-[3-(trifluoromethyl)phenyl]ethyl]carbamate

Names & synonyms

tert-Butyl {2-(methylsulphonyl)-1-[3-(trifluoromethyl)phenyl]ethyl}carbamateSCHEMBL10217130

Database identifiers

PubChem CID
59536720

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
80.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
24

Related reactions

2 records
New reaction record

Compound notes

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