4-Difluoromethoxymethyl-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester

HCID 66620438

Basic information

Standard SMILES
COC(=O)C1CC(COC(F)F)CN1C(=O)OC(C)(C)C
InChIKey
LQPPHHKIVZDDOI-UHFFFAOYSA-N
Molecular formula
C13H21F2NO5
Average molar mass
309.31 g/mol

Names & identifiers

Preferred name
4-Difluoromethoxymethyl-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester
IUPAC
1-O-tert-butyl 2-O-methyl 4-(difluoromethoxymethyl)pyrrolidine-1,2-dicarboxylate

Names & synonyms

4-Difluoromethoxymethyl-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester1378392-78-9O1-TERT-BUTYL O2-METHYL (2S,4S)-4-(DIFLUOROMETHOXYMETHYL)PYRROLIDINE-1,2-DICARBOXYLATESCHEMBL204045

Database identifiers

PubChem CID
66620438

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
65.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
7
Heavy atoms
21

Related reactions

17 records

Linked notes

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