HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

Lithium 3,5,5-trimethylhexanoate

HCID 178809074
New noteNew reactionRequest quotes
Print preview

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
57991-25-0
Standard SMILES
CC(CC(=O)[O-])CC(C)(C)C.[Li+]
InChIKey
DTDHRKYGRDIWQN-UHFFFAOYSA-M
Molecular formula
C9H17LiO2
Average molar mass
164.2 g/mol

Names & identifiers

Preferred name
Lithium 3,5,5-trimethylhexanoate
IUPAC
lithium 3,5,5-trimethylhexanoate
English name
Hexanoic acid,3,5,5-trimethyl-,lithium salt
Molecular weight
0

Names & synonyms

Hexanoic acid,3,5,5-trimethyl-,lithium saltHexanoic acid, 3,5,5-trimethyl-, lithium salt

Database identifiers

CAS
57991-25-0

Properties

Computed structural propertiesFilling in

Topological polar surface area
40.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
12
Formal charge
0
Complexity
138

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes