Basic information
- CAS
58757-61-2- Standard SMILES
CCCCCC(C)NCc1c(C)cc(C)cc1C- InChIKey
ZLVOFPSPMOLPJY-UHFFFAOYSA-N- Molecular formula
- C17H29N
- Average molar mass
- 247.4 g/mol
- Monoisotopic mass
- 247.22999993
Names & identifiers
- Preferred name
- Trimexiline
- IUPAC
- N-[(2,4,6-trimethylphenyl)methyl]heptan-2-amine
- English name
- Trimexiline
- Molecular formula
- C17H29N
- Molecular weight
- 247.423
Names & synonyms
TrimexilineTrimexilina58757-61-2Trimexiline [INN]TrimexilinumUNII-HUH663DN8FHUH663DN8F(+-)-2,4,6-Trimethyl-N-(1-methylhexyl)benzylamineRefChem:191828N-[(2,4,6-trimethylphenyl)methyl]heptan-2-amineorb2815107CHEMBL2104470
Show more names
( -)-2,4,6-Trimethyl-N-(1-methylhexyl)benzylamine
SCHEMBL11223490DTXSID20866706AKOS008991485NS00127254T202604(+/-)-2,4,6-Trimethyl-N-(1-methylhexyl)benzylamineQ27280115Z86141648
Database identifiers
- CAS
58757-61-2- PubChem CID
- 3045273
- DTXSID
DTXSID20866706- ChEMBL
CHEMBL2104470- UNII
- HUH663DN8F
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 202
Physicochemical properties
- FDA UNII
- 663 DN8F · HUH663DN8F
Chemistry & industry
Suppliers1 total
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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