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Ammonium, (2-phenoxyethyl)triethyl-, bromide

HCID 40270
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Basic information

CAS
52176-56-4
Standard SMILES
CC[N+](CC)(CC)CCOc1ccccc1.[I-]
InChIKey
UQIFOUORPWMOCM-UHFFFAOYSA-M
Molecular formula
C14H24INO
Average molar mass
349.25 g/mol
Monoisotopic mass
349.09026

Names & identifiers

Preferred name
Ammonium, (2-phenoxyethyl)triethyl-, bromide
IUPAC
triethyl(2-phenoxyethyl)azanium iodide

Names & synonyms

52176-56-4AMMONIUM, (2-PHENOXYETHYL)TRIETHYL-, BROMIDERefChem:1076738Phenoxyethyltriethylammonium bromideCHEMBL53967242-Phenoxy-N,N,N-triethylethanaminium bromideEthanaminium, 2-phenoxy-N,N,N-triethyl-, bromideNIOSH/BS1199250DTXSID20966538(2-Phenoxyethyl)triethylammonium iodideAmmonium, (2-phenoxyethyl)triethyl-, iodideBS11992500
Show more names
N,N,N-Triethyl-2-phenoxyethan-1-aminium iodide

Database identifiers

CAS
52176-56-4
PubChem CID
40270
DTXSID
DTXSID20966538
ChEMBL
CHEMBL5396724

Properties

Computed structural properties

Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
7
Heavy atoms
17
Formal charge
0
Complexity
163

Related reactions

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Compound notes

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