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

1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-

HCID 392343
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
110076-36-3
Standard SMILES
CC(C)N1CCN(C(C)C)CCN(C(C)C)CC1
InChIKey
UUBBDZVLOQSJSB-UHFFFAOYSA-N
Molecular formula
C15H33N3
Average molar mass
255.44 g/mol
Monoisotopic mass
255.26744807

Names & identifiers

Preferred name
1H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-
IUPAC
1,4,7-tri(propan-2-yl)-1,4,7-triazonane

Names & synonyms

110076-36-31H-1,4,7-Triazonine, octahydro-1,4,7-tris(1-methylethyl)-DTXSID50327835RefChem:237124DTXCID202789461,4,7-tri(propan-2-yl)-1,4,7-triazonane1,4,7-tris(propan-2-yl)-1,4,7-triazonane1,4,7-triisopropyl-1,4,7-triazacyclononane1,4,7-TRIISOPROPYL-1,4,7-TRIAZONANESCHEMBL6660188

Database identifiers

CAS
110076-36-3
PubChem CID
392343
DTXSID
DTXSID50327835
Nikkaji
J1.111.190D

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
9.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Formal charge
0
Complexity
176

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