Thymol iodide

Base Information

• Chemical Name: Thymol iodide
• CAS No.: 552-22-7
• Deprecated CAS: 8048-66-6
• Molecular Formula: C20H24I2O2
• Molecular Weight: 550.21
• Hs Code.: 2908199090
• European Community (EC) Number: 209-007-5
• NSC Number: 2222
• UNII: A51HJM3XSU
• DSSTox Substance ID: DTXSID3046081
• Nikkaji Number: J6.718K
• Wikidata: Q27273640
• NCI Thesaurus Code: C84206
• ChEMBL ID: CHEMBL1482931
• Mol file: 552-22-7.mol

Synonyms:THYMOL IODIDE;552-22-7;Iodothymol;Iodistol;Iodohydromol;Annidalin;Aristol;Iodosol;Iothymol;Lothymol;Thymiode;Thymiodol;Thymodin;Thymotol;Iosol;THYMOLIODIDE;Diiododithymol;Bithymol diiodide;Dithymol diiodide;[4-(4-iodooxy-2-methyl-5-propan-2-ylphenyl)-5-methyl-2-propan-2-ylphenyl] hypoiodite;Iodothymol (VAN);Thymol iodide [NF];UNII-A51HJM3XSU;A51HJM3XSU;HSDB 867;DTXSID3046081;NSC 2222;NSC-2222;EINECS 209-007-5;NCGC00159504-02;5,5'-Diisopropyl-2,2'-dimethylbiphenyl-4,4'-diyl dihypoiodite;1,1'-Biphenyl, 4,4'-bis(iodooxy)-2,2'-dimethyl-5, 5'-bis(1-methylethyl)-;4,4'-Bis(iodooxy)-2,2'-dimethyl-5,5'-bis(1-methylethyl-1,1'-biphenyl;DTXCID1026081;4,4'-bis(I4,4'-Bodooxy)-2,2'-dimethyl-5,5'-bis(1-methylethyl-1,1'-biphenyl;Hypoiodous acid, 2,2'-dimethyl-5,5'-bis(1-methylethyl)(1,1'-biphenyl)-4,4'-diyl ester;CAS-552-22-7;thymol-iodide;Hypoiodous acid, 2,2'-dimethyl-5,5'-bis(1-methylethyl)[1,1'-biphenyl]-4,4'-diyl ester;C20H24I2O2;THYMOL IODIDE [HSDB];SCHEMBL467308;THYMOL IODIDE [VANDF];THYMOL IODIDE [WHO-DD];CHEMBL1482931;NSC2222;HY-B1796;Tox21_111723;AKOS024319269;C20-H24-I2-O2;Tox21_111723_1;Hypoiodous acid, 2,2'-dimethyl-5,5'-bis(1- methylethyl)[1,1'-biphenyl]-4,4'-diyl ester;NCGC00159504-03;NCGC00159504-04;THYMOL IODIDE or DITHYMOL DIIODIDE;BS-28664;CS-0013832;SR-01000883682;SR-01000883682-1;Q27273640;1, 4,4'-bis(iodooxy)-2,2'-dimethyl-5,5'-bis(1-methylethyl)-;4'-(iodooxy)-2,2'-dimethyl-5,5'-bis(propan-2-yl)-[1,1'-biphenyl]-4-yl hypoiodite;Hypoiodous acid,2'-dimethyl-5,5'-bis(1-methylethyl)[1,1'-biphenyl]-4,4'-diyl ester;Hypoiodous acid, I,I'-(2,2'-dimethyl-5,5'-bis(1-methylethyl)(1,1'-biphenyl)-4,4'-diyl) ester

Chemical Property of Thymol iodide

Chemical Property:

• Appearance/Colour: reddish-brown or yellow crystalline powder
• Vapor Pressure: 7.11E-09mmHg at 25°C
• Melting Point: 69oC
• Refractive Index: 1.616
• Boiling Point: 479 °C at 760 mmHg
• Flash Point: 243.5 °C
• PSA: 18.46000
• Density: 1.617g/cm³
• LogP: 7.67480
• Storage Temp.: 2-8°C
• XLogP3: 8.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 549.98658
• Heavy Atom Count: 24
• Complexity: 352

Purity/Quality:

99.9% ^*data from raw suppliers

Thymol iodide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C,Xn
• Statements: 34-22
• Safety Statements: 36/37/39-26

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Other Uses -> Biocides/Disinfectants
• Canonical SMILES: CC1=CC(=C(C=C1C2=CC(=C(C=C2C)OI)C(C)C)C(C)C)OI
• Uses: Feed additive, antifungal agent. Thymol iodide is a dithymol diiodide compound.