Tert-butyl 2-[[4-(4-iodobenzoyl)phenoxy]methyl]pyrrolidine-1-carboxylate

HCID 69001039
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCCC1COc1ccc(C(=O)c2ccc(I)cc2)cc1
InChIKey
CYVDEIZESDIUIE-UHFFFAOYSA-N
Molecular formula
C23H26INO4
Average molar mass
507.4 g/mol
Monoisotopic mass
507.09066

Names & identifiers

Preferred name
Tert-butyl 2-[[4-(4-iodobenzoyl)phenoxy]methyl]pyrrolidine-1-carboxylate
IUPAC
tert-butyl 2-[[4-(4-iodobenzoyl)phenoxy]methyl]pyrrolidine-1-carboxylate

Names & synonyms

SCHEMBL4318145

Database identifiers

PubChem CID
69001039

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
55.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
29

Related reactions

3 records
New reaction record

Compound notes

Loading…

Tert-butyl 2-[[4-(4-iodobenzoyl)phenoxy]methyl]pyrrolidine-1-carboxylate (HCID 69001039)｜Huagongshe