HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

1-tert-Butyl 8-(2,5-dioxopyrrolidin-1-yl) octanedioate

HCID 59760896
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)OC(=O)CCCCCCC(=O)ON1C(=O)CCC1=O
InChIKey
WNKBCGWPUFBYBA-UHFFFAOYSA-N
Molecular formula
C16H25NO6
Average molar mass
327.37 g/mol

Names & identifiers

Preferred name
1-tert-Butyl 8-(2,5-dioxopyrrolidin-1-yl) octanedioate
IUPAC
1-O-tert-butyl 8-O-(2,5-dioxopyrrolidin-1-yl) octanedioate

Names & synonyms

905735-75-31-tert-Butyl 8-(2,5-dioxopyrrolidin-1-yl) octanedioateoctanedioic acid tert-butyl ester 2,5-dioxo-pyrrolidin-1-yl esterMFCD313816241-O-tert-butyl 8-O-(2,5-dioxopyrrolidin-1-yl) octanedioate1-(TERT-BUTYL) 8-(2,5-DIOXOPYRROLIDIN-1-YL) OCTANEDIOATEOctanedioic acid tert-butyl ester 2,5-dioxopyrrolidin-1-yl esterSCHEMBL11920409WNKBCGWPUFBYBA-UHFFFAOYSA-NAKOS037654933AT36478MS-21643
Show more names
F577203A1-06574Octanedioic acid, 1-(1,1-dimethylethyl) 8-(2,5-dioxo-1-pyrrolidinyl) ester

Database identifiers

PubChem CID
59760896

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
90 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
23
Formal charge
0
Complexity
450

Related reactions

3 records
New reaction record
HRID 535284 reaction equation
HRID 535284As productuspto-grants-2014_10
HRID 535288 reaction equation
HRID 535288As reactantuspto-grants-2014_10
HRID 1425661 reaction equation
HRID 1425661As productuspto-grants-2015_01

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes