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Lithium iodide

HCID 66321
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Basic information

CAS
10377-51-2
Standard SMILES
[I-].[Li+]
InChIKey
HSZCZNFXUDYRKD-UHFFFAOYSA-M
Molecular formula
ILi
Average molar mass
133.9 g/mol
Monoisotopic mass
133.92048

Names & identifiers

Preferred name
Lithium iodide
IUPAC
lithium iodide
English name
Lithium iodide anhydrous
Molecular formula
ILi
Molecular weight
133.85

Names & synonyms

Lithium iodideLithium monoiodideLithium iodide (LiI)UNII-S6K2XET783S6K2XET783EINECS 233-822-5LITHIUM IODIDE [MI]DTXSID30908580RefChem:153730DTXCID301337657233-822-510377-51-2
Show more names
LiILithiumiodidTenephrolLithiumjodidithium iodideIodide lithiuMlithiumiodide(lii)lithiumiodide(bpc)
lithiumiodideLithium iodide, anhydrouslithium;iodideMFCD00011092Lithium iodide (6LiI)lLithiumiodid21752-61-4LiI.xH2O

Database identifiers

CAS
10377-51-2、21752-61-4、29911-74-8
PubChem CID
66321
DTXSID
DTXSID30908580
UNII
S6K2XET783
EC Number
233-822-5、244-572-1
Nikkaji
J43.854E

Properties

Computed structural propertiesFilling in

Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
2
Formal charge
0
Complexity
2

Experimental & physicochemical properties

Density4.06 @25 °C
Boiling Point1171 °C @760 [mm Hg]
Physical DescriptionTrihydrate: White, extremely hygroscopic solid; Soluble in water; [Hawley] White, light yellow, or pink odorless powder; Soluble in water; [MSDSonline]

Physicochemical properties

Melting point
446 °C · 446 °C(lit.)
Boiling point
1171 °C · 1171 °C
Density
3.49 g/mL · 3.49 g/mL at 25 °C(lit.)
bulk density
1000 kg/m3 · 1000kg/m3
refractive index
1.955 · 1.955
Flash point
1170 · 1170-1190°C
storage temp.
30 °C · Store below +30°C.
solubility
1640 g/l · 1640g/l soluble
form
powder
color
White to yellow to beige
Specific Gravity
4.076 · 4.076
Water Solubility
Soluble in water, ethanol and acetone.
Specific Heat Capacity
0.38 J/ · Cp(crystal): 0.38 J/(g·K), at 25℃
Sensitive
Hygroscopic
Merck
14 · 14,5535
Stability
hygroscopic
Major Application
battery precursorscatalystsmaterial synthesis precursor
InChI
1S/HI.Li/h1H;/q;+1/p-1
InChIKey
HSZCZNFXUDYRKD-UHFFFAOYSA-M
SMILES
[Li+].[I-]
Indirect Additives used in Food Contact Substances
LITHIUM IODIDE
FDA 21 CFR
178.201 · 178.2010
CAS DataBase Reference
10377 · 10377-51-2(CAS DataBase Reference)
FDA UNII
6 K2XET783 · S6K2XET783
EPA Substance Registry System
Lithium iodide (10377-51-2)
UNSPSC Code
12352302 · 12352302
NACRES
23 · NA.23
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319
Precautionary statements
264 · P264-P280a-P305+P351+P338-P321-P332+P313-P337+P313
PPE
95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes
Xi
Risk Statements
36 · 36/38-36/37/38-22
Safety Statements
26 · 26-37/39
WGK Germany
1 · 1
F
3 · 3-8-10-23
TSCA
TSCA listed
HS Code
2827600000 · 2827600000
Storage Class
11 · 11 - Combustible Solids
REACH Registrations
Active

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 6 items

This chemical does not meet GHS hazard criteria for 17.2% (43 of 250) of reports.

Warning

H302 (14%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (67.2%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (72.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (47.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H400 (44%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 250 reports by companies from 13 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 43 of 250 reports by companies.;There are 11 notifications provided by 207 of 250 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Regulatory Information · 3 items

Chemical: Lithium iodide (LiI)

Status: Active Update: 25-08-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/34023

Lithium iodide (LiI): Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Lithium iodide (LiI): Human health tier I assessment
Hazards SummaryAn irritant; [MSDSonline] See Iodine for the TLV of Iodides.
Hazard Classes and Categories · 2 items

Skin Irrit. 2 (100%);Eye Irrit. 2 (100%)

Acute Tox. 4 (14%);Skin Irrit. 2 (67.2%);Eye Irrit. 2 (72.4%);STOT SE 3 (47.6%);Aquatic Acute 1 (44%)

Safety & protection

Threshold Limit Values (TLV)0.01 [ppm], inhalable fraction and vapor (iodides)
Protective Action Criteria (PAC) · 3 items

12 [mg/m3]

130 [mg/m3]

790 [mg/m3]

Toxicology

Adverse EffectsNeurotoxin - Other CNS neurotoxin;Nephrotoxin - The chemical is potentially toxic to the kidneys in the occupational setting.

Regulatory information

Regulatory Information · 3 items

Chemical: Lithium iodide (LiI)

Status: Active Update: 25-08-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/34023

Lithium iodide (LiI): Does not have an individual approval but may be used under an appropriate group standard

Safety data

F
3-8-10-23
PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
1
tsca
TSCA listed
hs_code
2827600000
risk_code
36/38-36/37/38-22
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-37/39
Storage Class
11 - Combustible Solids
Hazard statements
H315-H319
REACH Registrations
Active
Precautionary statements
P264-P280a-P305+P351+P338-P321-P332+P313-P337+P313

Chemistry & industry

Uses & manufacturing

Uses · 2 items

Used in photography; [Merck Index] Trihydrate: Used in air conditioning and as a catalyst; [Hawley] Used in organic synthesis; [Ullmann]

Photographic Processing [Category: Other]

General Manufacturing Information · 2 items

Lithium iodide (LiI): ACTIVE

Lithium iodide (6LiI): ACTIVE

Applications · 5 items

DescriptionLithium iodide (chemical formula: LiI) is the compound of lithium and iodine. It can be used as an electrolyte in high-temperature batteries, long-life batteries which is required, e.g. by artificial pacemaker as well as in the electrolyte of dye-sensitized solar cells. In organic synthesis, it can be used for C-O bonds cleavage such as converting methyl esters to carboxylic acids. In addition, it can be used as a radio contrast agent for X-ray computed tomography imaging studies.

UsesLithium iodide can be used for the catalytic dehydrogenation of hydrocarbons. Oxidation of lithium iodide yields iodine which reacts with the hydrocarbon to form an organic iodide. The intermediate is dehydroiodinated to yield an olefin.For example, butane may be converted to butadiene.

UsesControls regioselectivity in palladium catalyzed allylic alkylation reactions.1

UsesIt is used as a absorbent in refrigeration process, as a catalyst, and in photography. It is also useful for organic synthesis, pessat iodination, cleavage of esters, ethers, epoxides, decarboethoxylation, carbonylation, and aldol condensation. It is used for manufacturing medicines and mineral waters. It is used in electochemicstry and redox reactions. Lithium iodide is also a catalyzed conjugate addition reaction of β-dicarbonyl compounds. It is also useful for tetrathioquinodimethane.

UsesControls regioselectivity in palladium-catalyzed allylic alkylation reactions.

Preparation methods · 2 items

PreparationThe laboratory preparation of lithium iodide is carried out in much the same way as the industrial preparation. Lithium iodide is prepared by the reaction of lithium hydroxide monohydrate or lithium carbonate with hydriodic acid, which may be prepared in situ by the reduction of iodine. The iodide is usually not isolated as the anhydrous material but is used as a solution or as the solid lithium iodide trihydrate. Hydriodic acid may be prepared by the reaction of hydrogen sulfide and iodine. The hydriodic acid solution must be kept under an inert atmosphere to prevent air oxidation to iodine. After combination of the acid with the lithium compounds, the solution may be evaporated to yield lithium iodide trihydrate, LiI· 3H20. The anhydrous material may be made by extremely careful dehydration of the trihydrate under vacuum and with slow heating. The lithium iodide or its trihydrate must be handled under an inert atmosphere to avoid oxidation of the iodide ion to iodine.

PreparationThe trihydrate salt is obtained by neutralization of lithium hydroxide or lithium carbonate solution with pure hydriodic acid followed by concentration of the solution for crystallization: LiOH + HI → LiI + H2O When heated in a vacuum, the trihydrate dehydrates to anhydrous salt.

Upstream & downstream products

Downstream products

4,4-Dimethyl-2-pentanone2,4-Dichloro-5-iodopyrimidine

Related reactions

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HRID 2539 reaction equation
HRID 2539As reactantuspto-grants-1998_03
HRID 2540 reaction equation
HRID 2540As reactantuspto-grants-1998_03
HRID 2541 reaction equation
HRID 2541As reactantuspto-grants-1998_03
HRID 2546 reaction equation
HRID 2546As reactantuspto-grants-1998_03
HRID 2548 reaction equation
HRID 2548As reactantuspto-grants-1998_03
HRID 2564 reaction equation
HRID 2564As reactantuspto-grants-1998_03
HRID 5950 reaction equation
HRID 5950As reactantuspto-grants-1993_09
HRID 14060 reaction equation
HRID 14060As reactantuspto-grants-2010_06
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Compound notes

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