Thiothiamine
Thiothiamine structure
|
Common Name | Thiothiamine | ||
|---|---|---|---|---|
| CAS Number | 299-35-4 | Molecular Weight | 296.41200 | |
| Density | 1.42g/cm3 | Boiling Point | 509.6ºC at 760mmHg | |
| Molecular Formula | C12H16N4OS2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 262ºC | |
Summary: Thiothiamine (Chinese name: 硫代硫胺素), molecular formula C12H16N4OS2, molecular weight 296.41200, CAS number 299-35-4. It should be stored at 2-8°C, away from light, under an inert gas. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Thiothiamine |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.42g/cm3 |
|---|---|
| Boiling Point | 509.6ºC at 760mmHg |
| Molecular Formula | C12H16N4OS2 |
| Molecular Weight | 296.41200 |
| Flash Point | 262ºC |
| Exact Mass | 296.07700 |
| PSA | 137.29000 |
| LogP | 2.43240 |
| Vapour Pressure | 3.28E-11mmHg at 25°C |
| Index of Refraction | 1.709 |
| InChIKey | SQOCQQPFEFRKBV-UHFFFAOYSA-N |
| SMILES | Cc1ncc(Cn2c(C)c(CCO)sc2=S)c(N)n1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 4 | |
CAS#:95-02-3
CAS#:67-03-8
CAS#:100502-51-0
CAS#:70-16-6![3-(4-amino-2-methyl-pyrimidin-5-ylmethyl)-3a-methyl-tetrahydro-furo[2,3-d]thiazole-2-thione Structure](https://image.chemsrc.com/caspic/382/108669-31-4.png)
CAS#:108669-31-4
CAS#:13051-49-5
CAS#:490-82-4
CAS#:532-43-4
CAS#:59-43-8This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-[(4-Amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methylthiazol-2(3H)-thione |
| 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazole-2-thione |
| Thiamine impurity E |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the downstream products of Thiothiamine? |
| A: Related downstream products(CAS) of Thiothiamine: 490-82-4;532-43-4;59-43-8;70-16-6. |
| Q: What is the molecular weight of Thiothiamine? |
| A: Molecular weight of Thiothiamine is 296.41200. |
| Q: What is the CAS number of Thiothiamine? |
| A: CAS number of Thiothiamine is 299-35-4. |
| Q: What is the InChIKey of Thiothiamine? |
| A: InChIKey of Thiothiamine is SQOCQQPFEFRKBV-UHFFFAOYSA-N. |
| Q: What is the LogP of Thiothiamine? |
| A: LogP of Thiothiamine is 2.43240. |
| Q: What is the SMILES notation of Thiothiamine? |
| A: SMILES notation of Thiothiamine is Cc1ncc(Cn2c(C)c(CCO)sc2=S)c(N)n1. |
| Q: What is the molecular formula of Thiothiamine? |
| A: Molecular formula of Thiothiamine is C12H16N4OS2. |
| Q: What English synonyms does Thiothiamine have? |
| A: English synonyms of Thiothiamine: 3-[(4-Amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methylthiazol-2(3H)-thione, 3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-hydroxyethyl)-4-methyl-1,3-thiazole-2-thione, Thiamine impurity E. |
| Q: What is the English name of Thiothiamine? |
| A: The English name of Thiothiamine is Thiothiamine. |
| Q: What are the upstream materials of Thiothiamine? |
| A: Related upstream materials(CAS) of Thiothiamine: 95-02-3;67-03-8;100502-51-0;70-16-6;108669-31-4;13051-49-5. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |