HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.9
  1. Home
  2. /Compound

Ammonium, oxybis(trimethylene)bis(ethyldimethyl-, dibromide

HCID 46895
New noteNew reactionRequest quotesPrint preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
64049-61-2
Standard SMILES
CC[N+](C)(C)CCCOCCC[N+](C)(C)CC.[Br-].[Br-]
InChIKey
VDFWPNHAXLIYBZ-UHFFFAOYSA-L
Molecular formula
C14H34Br2N2O
Average molar mass
406.24 g/mol
Monoisotopic mass
404.10379

Names & identifiers

Preferred name
Ammonium, oxybis(trimethylene)bis(ethyldimethyl-, dibromide
IUPAC
ethyl-[3-[3-[ethyl(dimethyl)azaniumyl]propoxy]propyl]-dimethylazanium dibromide

Names & synonyms

AMMONIUM, OXYBIS(TRIMETHYLENE)BIS(ETHYLDIMETHYL-, DIBROMIDE64049-61-2RefChem:1076904AS-16,702DTXSID609823383,3'-oxybis(N-ethyl-N,N-dimethylpropan-1-aminium) dibromide

Database identifiers

CAS
64049-61-2
PubChem CID
46895
DTXSID
DTXSID60982338

Properties

Computed structural properties

Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
10
Heavy atoms
19
Formal charge
0
Complexity
171

Suppliers

Loading…

Open inquiries

Loading…

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes