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

Triethyl cyclopropane-1,1,2-tricarboxylate

HCID 322700
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
839-39-4
Standard SMILES
CCOC(=O)C1CC1(C(=O)OCC)C(=O)OCC
InChIKey
ZQGANJPKLOBZQD-UHFFFAOYSA-N
Molecular formula
C12H18O6
Average molar mass
258.27 g/mol
Monoisotopic mass
258.11033829

Names & identifiers

Preferred name
Triethyl cyclopropane-1,1,2-tricarboxylate
IUPAC
triethyl cyclopropane-1,1,2-tricarboxylate

Names & synonyms

triethyl cyclopropane-1,1,2-tricarboxylate839-39-4DTXSID00314134RefChem:386115DTXCID00265258NSC280805NSC-280805

Database identifiers

CAS
839-39-4
PubChem CID
322700
DTXSID
DTXSID00314134

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
78.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
18
Formal charge
0
Complexity
330

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes