tert-Butyl 1-(4-cyanobenzyl)azetidine-3-carboxylate

HCID 58504367

Basic information

Standard SMILES
CC(C)(C)OC(=O)C1CN(Cc2ccc(C#N)cc2)C1
InChIKey
ZLGJRPZLBZZQNA-UHFFFAOYSA-N
Molecular formula
C16H20N2O2
Average molar mass
272.34 g/mol

Names & identifiers

Preferred name
tert-Butyl 1-(4-cyanobenzyl)azetidine-3-carboxylate
IUPAC
tert-butyl 1-[(4-cyanophenyl)methyl]azetidine-3-carboxylate

Names & synonyms

tert-Butyl 1-(4-cyanobenzyl)azetidine-3-carboxylate1236144-53-8tert-butyl 1-[(4-cyanophenyl)methyl]azetidine-3-carboxylateSCHEMBL407731ZLGJRPZLBZZQNA-UHFFFAOYSA-NSB51537tert-Butyl1-(4-cyanobenzyl)azetidine-3-carboxylatetert-Butyl 1-(4-cyanobenzyl)azetidine-3-carboxylate, 97%

Database identifiers

PubChem CID
58504367

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
53.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
20

Related reactions

12 records

Compound notes

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