3,5,5-trimethyl-N-[2-(3,5,5-trimethylhexylideneamino)ethyl]hexan-1-imine

HCID 348481

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Basic information

CAS: 7598-56-3
Standard SMILES: CC(CC=NCCN=CCC(C)CC(C)(C)C)CC(C)(C)C
InChIKey: XPDSARUMAVQAKY-UHFFFAOYSA-N
Molecular formula: C20H40N2
Average molar mass: 308.5 g/mol
Monoisotopic mass: 308.31914928

Names & identifiers

Preferred name: 3,5,5-trimethyl-N-[2-(3,5,5-trimethylhexylideneamino)ethyl]hexan-1-imine
IUPAC: 3,5,5-trimethyl-N-[2-(3,5,5-trimethylhexylideneamino)ethyl]hexan-1-imine

Names & synonyms

7598-56-3NSC4078033,5,5-trimethyl-N-[2-(3,5,5-trimethylhexylideneamino)ethyl]hexan-1-imineDTXSID40324838NSC-407803(1E,1'E)-N,N'-(Ethane-1,2-diyl)bis(3,5,5-trimethylhexan-1-imine)

Database identifiers

CAS: 7598-56-3
PubChem CID: 348481
DTXSID: DTXSID40324838

Properties

Computed structural properties

XLogP: 5.4
Topological polar surface area: 24.7 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 11
Heavy atoms: 22
Formal charge: 0
Complexity: 295

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