| Identification | Back Directory | [Name]
DL-GOITRIN | [CAS]
13190-34-6 | [Synonyms]
DL-GOITRIN
500-12-9 (L)
(+/-)-GOITRIN
Einecs 236-145-3
DL-Goitrin, 98+%
5-Vinylthiooxazolidone
5-vinyloxazolidine-2-thione
5-Vinyloxazolidone-2-thione
5-Ethenyl-2-oxazolidinethione
2-Oxazolidinethione, 5-ethenyl-
5-Vinyl-1,3-oxazolidine-2-thione | [EINECS(EC#)]
236-145-3 | [Molecular Formula]
C5H7NOS | [MDL Number]
MFCD00015467 | [MOL File]
13190-34-6.mol | [Molecular Weight]
129.18 |
| Chemical Properties | Back Directory | [Melting point ]
64-65°C | [Boiling point ]
150.6±43.0 °C(Predicted) | [density ]
1.19±0.1 g/cm3(Predicted) | [storage temp. ]
Store at -20°C | [solubility ]
Soluble in DMSO | [form ]
A crystalline solid | [pka]
13.34±0.40(Predicted) | [color ]
White to off-white | [Merck ]
14,4513 | [BRN ]
80669 | [InChI]
InChI=1S/C5H7NOS/c1-2-4-3-6-5(8)7-4/h2,4H,1,3H2,(H,6,8) | [InChIKey]
UZQVYLOFLQICCT-UHFFFAOYSA-N | [SMILES]
O1C(C=C)CNC1=S |
| Hazard Information | Back Directory | [Uses]
DL-Goitrin is a sulfur-containing oxazolidine, a cyclic thiocarbamate, that reduces the production of thyroid hormones such as thyroxine. | [Definition]
ChEBI: 5-ethenyl-1,3-oxazolidine-2-thione is a member of the class of oxazolidines that is 1,3-oxazolidine substituted by sulfanylidene and ethenyl groups at positions 2 and 5, respectively. It is a member of oxazolidines and an olefinic compound. | [Synthesis Reference(s)]
Journal of the American Chemical Society, 72, p. 4792, 1950 DOI: 10.1021/ja01166a126
Journal of Heterocyclic Chemistry, 27, p. 811, 1990 DOI: 10.1002/jhet.5570270361 |
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