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

CID 33573

HCID 33573
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
26655-49-2
Standard SMILES
CCCCC(Cl)CCC.CCCCCC(Cl)CC.CCCCCCC(C)Cl
InChIKey
ODPGVUPAQDFIER-UHFFFAOYSA-N
Molecular formula
C24H51Cl3
Average molar mass
446 g/mol
Monoisotopic mass
444.305635

Names & identifiers

Preferred name
CID 33573
IUPAC
2-chlorooctane;3-chlorooctane;4-chlorooctane

Names & synonyms

26655-49-2SCHEMBL2304662-chlorooctane;3-chlorooctane;4-chlorooctane

Database identifiers

CAS
26655-49-2
PubChem CID
33573

Properties

Computed structural properties

Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
15
Heavy atoms
27
Formal charge
0
Complexity
158

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes