CAS Number6336-50-1
SynonymsBasdene; 6-benzyl-2-thiouracil; 6-benzyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one; Benzylthiouracil; 6-benzyl-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one; 3,4-dihydro-6-phenylmethyl-2-thioxopyrimidin-4(3H)-one; 6-benzyl thiouracil
Molecular FormulaC11H10N2OS
Molecular Weight218.279
Density1.32g/cm3
Boiling Point438.1ºC at 760 mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 6336-50-1 |
| Catalog No. | 2A-9080040 |
| Chinese Name | 6-苄基-2-硫代-2,3-二氢嘧啶-4(1H)-酮 |
| Synonyms | Basdene; 6-benzyl-2-thiouracil; 6-benzyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one; Benzylthiouracil; 6-benzyl-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one; 3,4-dihydro-6-phenylmethyl-2-thioxopyrimidin-4(3H)-one; 6-benzyl thiouracil |
| Molecular Formula | C11H10N2OS |
| Molecular Weight | 218.279 |
| Density | 1.32g/cm3 |
| Boiling Point | 438.1ºC at 760 mmHg |
| Storage Condition | -20°C |
| Application | Benzylthiouracil is an active pharmaceutical ingredient against hyperthyroidism [1]. |
| HTC | 2933599090 |
| PubChem ID | 72476 |
| MDL Number | MFCD00023224 |
| SMILES | O=c1cc(Cc2ccccc2)[nH]c(=S)[nH]1 |
| InChI | InChI=1S/C11H10N2OS/c14-10-7-9(12-11(15)13-10)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,12,13,14,15) |
| InChI Key | PNXBXCRWXNESOV-UHFFFAOYSA-N |
| MSDS | msds/80040_1_6336_50_1.pdf |
| Bioactivity | Benzylthiouracil is an active pharmaceutical ingredient against hyperthyroidism[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others References [1]. Rietveld IB, et al. Polymorphism of benzylthiouracil, an active pharmaceutical ingredient against hyperthyroidism. Int J Pharm. 2021;598:120378. Chemical & Physical Properties Density 1.32g/cm3 Boiling Point 438.1ºC at 760 mmHg Molecular Formula C11H10N2OS Molecular Weight 218.27500 Flash Point 218.8ºC Exact Mass 218.05100 PSA 80.74000 LogP 2.02330 Index of Refraction 1.678 InChIKey PNXBXCRWXNESOV-UHFFFAOYSA-N SMILES O=c1cc(Cc2ccccc2)[nH]c(=S)[nH]1 Storage condition -20°C |
| Use of | Benzylthiouracil is an active pharmaceutical ingredient against hyperthyroidism[1]. Properties Name 6-benzyl-2-sulfanylidene-1H-pyrimidin-4-one Synonym More Synonyms Benzylthiouracil Biological Activity Description Benzylthiouracil is an active pharmaceutical ingredient against hyperthyroidism[1]. Related Catalog Research Areas >> Others Signaling Pathways >> Others >> Others References [1]. Rietveld IB, et al. Polymorphism of benzylthiouracil, an active pharmaceutical ingredient against hyperthyroidism. Int J Pharm. 2021;598:120378. Chemical & Physical Properties Molecular Formula C11H10N2OS Exact Mass 218.05100 PSA 80.74000 LogP 2.02330 Index of Refraction 1.678 InChIKey PNXBXCRWXNESOV-UHFFFAOYSA-N |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Summary 2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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