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

2,4,5-T trimethylamine salt

HCID 61397
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
6369-96-6
Standard SMILES
CN(C)C.O=C(O)COc1cc(Cl)c(Cl)cc1Cl
InChIKey
NIUIAPURUKNXIY-UHFFFAOYSA-N
Molecular formula
C11H14Cl3NO3
Average molar mass
314.6 g/mol
Monoisotopic mass
313.003926

Names & identifiers

Preferred name
2,4,5-T trimethylamine salt
IUPAC
N,N-dimethylmethanamine;2-(2,4,5-trichlorophenoxy)acetic acid

Names & synonyms

2,4,5-T trimethylamine salt6369-96-62,4,5-T trimethylamineSCHEMBL8709343

Database identifiers

CAS
6369-96-6
PubChem CID
61397

Properties

Computed structural properties

Topological polar surface area
49.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
18
Formal charge
0
Complexity
220

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes