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3-Hydroxypropyl-dimethyl-octadecylazanium (HCID 14625554)|Huagongshe
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Compound
3-Hydroxypropyl-dimethyl-octadecylazanium
HCID
14625554
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCO
InChIKey
LOGPGJLLNPDNKZ-UHFFFAOYSA-N
Molecular formula
C23H50NO+
Average molar mass
356.6 g/mol
Names & identifiers
Preferred name
3-Hydroxypropyl-dimethyl-octadecylazanium
IUPAC
3-hydroxypropyl-dimethyl-octadecylazanium
Names & synonyms
SCHEMBL97763
Database identifiers
PubChem CID
14625554
Nikkaji
J2.472.594D
Properties
Computed structural properties
XLogP
8.8
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
20
Heavy atoms
25
Formal charge
1
Complexity
252
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Related reactions
1 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
1555832
As product
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Compound notes
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