ChemicalBook--->CAS DataBase List--->300-39-0

300-39-0

300-39-0 Structure

300-39-0 Structure
IdentificationMore
[Name]

3,5-Diiodo-L-tyrosine dihydrate
[CAS]

300-39-0
[Synonyms]

3,5-DIIODINE-L-TYROSINE
3,5-DIIODO-4-HYDROXY-BETA-PHENYLALANINE
3,5-DIIODO-BETA(4-HYDROXYPHENYL)ALANINE
3,5-DIIODO-L-TYROSINE
3,5-DIIODO-TYROSINE
4-HYDROXY-3,5-DIIODOPHENYLALANINE, 2-AMINO-3-(4-HYDROXY-3,5-DIIODOPHENYL)PROPIONIC ACID
AGONTAN
DITYRIN
H-3,5-DIIODO-TYR-OH
H-L-TYR(3,5-I2)-OH
H-TYR(3,5-I2)-OH
IODOGORGOIC ACID
L-TYROSINE, 3,5-DIIODO-
3,5-Diiodo-4-hydroxy-β-phenylalanine
3,5-diiodo-l-tyrosin
3,5-Diiodotyrocine
3,5-Iodo-L-tyrosine
3,5-L-Diiodotyrosine
4-Hydroxy-3,5-diiodophenylalanine
diiodotyrosine
[EINECS(EC#)]

206-092-0
[Molecular Formula]

C9H13I2NO5
[MDL Number]

MFCD00016542
[Molecular Weight]

469.01
[MOL File]

300-39-0.mol
Chemical PropertiesBack Directory
[Appearance]

white to beige powder
[Melting point ]

200 °C (dec.)(lit.)
[alpha ]

-20.7 º (c=2.5, 0.1N NaOH/H2O)
[Boiling point ]

546.5°C (rough estimate)
[density ]

2.405±0.06 g/cm3(Predicted)
[refractive index ]

1.2 ° (C=5, 1mol/L HCl)
[storage temp. ]

2-8°C
[solubility ]

Aqueous Acid (Slightly), DMSO (Slightly)
[form ]

crystalline
[pka]

2.12(at 25℃)
[color ]

white
[Water Solubility ]

slightly soluble
[Sensitive ]

Light Sensitive
[Major Application]

pharmaceutical
[CAS DataBase Reference]

300-39-0(CAS DataBase Reference)
[NIST Chemistry Reference]

3,5-Diiodo-l-tyrosine(300-39-0)
[EPA Substance Registry System]

300-39-0(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
S36/37:Wear suitable protective clothing and gloves .
[RIDADR ]

2811
[WGK Germany ]

3
[F ]

8
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29225090
[Storage Class]

11 - Combustible Solids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

L-Tyrosine-->Ammonia-->Iodine
[Preparation Products]

Levothyroxine-->3-Iodo-L-tyrosine-->N-Acetyl-3,5-diiodo-L-tyrosine ethyl ester-->4-Hydroxyphenylacetamide-->Methyl 3,5-diiodo-L-tyrosinate-->Boc-3,5-diiodo-L-tyrosine
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3,5-Diiodo-L-tyrosine dihydrate(300-39-0).msds
Hazard InformationBack Directory
[Description]

Diiodotyrosine does not possess pronounced hormonal activity. However, it stops production of thyrotropic hormone by the anterior lobe of the hypophysis, which activates thyroid gland activity.
[Chemical Properties]

white to beige powder
[Uses]

It is used for hyperthyroid forms of endemic and sporadic goiters, diffuse, toxic goiters, and other illnesses accompanied by thyrotoxicity.
[Definition]

ChEBI: A diiodotyrosine that is L-tyrosine carrying iodo-substituents at positions C-3 and C-5 of the benzyl group. It is an intermediate in the thyroid hormone synthesis.
[Synthesis]

Diiodotyrosine, 3,5-diiodotyrosine (25.2.1), is synthesized by directly iodinating tyrosine with iodine in the presence of sodium iodide in aqueous ethylamine, or in a mixture of acetic and hydrochloric acids with the addition of hydrogen peroxide.

Synthesis_300-39-0

[Purification Methods]

It forms crystals from H2O [solubility (g/L): 0.204 at 0o, 1.86 at 50o, 5.6 at 75o and 17.0 at 100o]. Also recrystallise it from 50% or 70% EtOH. When boiled in EtOH the crystals swell, and on further boiling a gelatinous precipitate is formed [Harrington Biochem J 22 1434 1928, Jurd J Am Chem Soc 77 5747 1955]. It also crystallises from cold dilute ammonia on adding acetic acid to pH 6. [Beilstein 14 IV 2370.]
Spectrum DetailBack Directory
[Spectrum Detail]

3,5-Diiodo-L-tyrosine dihydrate(300-39-0)MS
3,5-Diiodo-L-tyrosine dihydrate(300-39-0)1HNMR
3,5-Diiodo-L-tyrosine dihydrate(300-39-0)IR1
3,5-Diiodo-L-tyrosine dihydrate(300-39-0)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3,5-Diiodo-L-tyrosine dihydrate, 99%(300-39-0)
[Sigma Aldrich]

300-39-0(sigmaaldrich)
[TCI AMERICA]

3,5-Diiodo-L-tyrosine  Dihydrate,>98.0%(T)(300-39-0)
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