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4,4-Dimethyl-2-undecyl-2-imidazoline

HCID 178442809
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCCCCCCCCCC1=NC(C)(C)CN1
InChIKey
KNHLGGZWFZIILI-UHFFFAOYSA-N
Molecular formula
C16H32N2
Average molar mass
252.44 g/mol
Monoisotopic mass
252.25654903

Names & identifiers

Preferred name
4,4-Dimethyl-2-undecyl-2-imidazoline
IUPAC
5,5-dimethyl-2-undecyl-1,4-dihydroimidazole

Names & synonyms

SCHEMBL9787867SCHEMBL9814329KNHLGGZWFZIILI-UHFFFAOYSA-N4,4-dimethyl-2-undecyl-2-imidazoline

Database identifiers

PubChem CID
14651796

Properties

Computed structural properties

XLogP
5
Topological polar surface area
24.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
10
Heavy atoms
18
Formal charge
0
Complexity
243

Related reactions

6 records
New reaction record
HRID 672378 reaction equation
HRID 672378As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 687506 reaction equation
HRID 687506As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 943466 reaction equation
HRID 943466As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1086439 reaction equation
HRID 1086439As productuspto-grants-1991_07
HRID 1086446 reaction equation
HRID 1086446As reactantuspto-grants-1991_07
HRID 2352208 reaction equation
HRID 2352208As reactantuspto-grants-1989_10

Compound notes

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