Quinolinium, 1-ethyl-4-methyl-, iodide (1:1)

HCID 69062

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Basic information

CAS: 605-59-4
Standard SMILES: CC[n+]1ccc(C)c2ccccc21.[I-]
InChIKey: VQDKCFLPUPEBJC-UHFFFAOYSA-M
Molecular formula: C12H14IN
Average molar mass: 299.15 g/mol
Monoisotopic mass: 299.01709745

Names & identifiers

Preferred name: Quinolinium, 1-ethyl-4-methyl-, iodide (1:1)
IUPAC: 1-ethyl-4-methylquinolin-1-ium iodide
English name: 1-Ethyl-4-methylquinolinium iodide
Molecular formula: C12H14IN
Molecular weight: 299.15

Names & synonyms

605-59-41-Ethyllepidinium iodideLepidinium ethiodide4-Methylquinoline ethiodideLepidinium, 1-ethyl-, iodideQuinolinium, 1-ethyl-4-methyl-, iodide (1:1)Quinolinium, 1-ethyl-4-methyl-, iodideNSC 204954DTXSID30883464RefChem:178292DTXCID2010229941-ethyl-4-methylquinolin-1-ium iodide

Show more names

1-ethyl-4-methyl-quinoliniuiodide

1-Ethyl-4-methylquinolinium iodideLepidine ethiodideMFCD001921601-ethyl-4-methylquinolin-1-ium;iodideNSC-2049541-Ethyl-4-methylquinoliniumiodiden-ethyllepidinium iodideC7W6WWW5FT

Database identifiers

CAS: 605-59-4
PubChem CID: 69062
DTXSID: DTXSID30883464
UNII: C7W6WWW5FT
EC Number: 622-952-1

Properties

Computed structural properties

Topological polar surface area: 3.9 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 14
Formal charge: 0
Complexity: 167

Physicochemical properties

Melting point: 143 · 143-146 °C(lit.)
FDA UNII: 7 W6WWW5FT · C7W6WWW5FT
EPA Substance Registry System: 1 · Quinolinium, 1-ethyl-4-methyl-, iodide (605-59-4)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36
WGK Germany: 3 · 3
TSCA: TSCA listed

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.