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Basic information
- CAS
6469-32-5- Standard SMILES
Cc1ncsc1CCC(=O)O- InChIKey
HPMBMJNAPIPXFK-UHFFFAOYSA-N- Molecular formula
- C7H9NO2S
- Average molar mass
- 171.221 g/mol
- Monoisotopic mass
- 171.03539953
Names & identifiers
- Preferred name
- 4-Methylthiazole-5-propionic acid
- IUPAC
- 3-(4-Methyl-1,3-thiazol-5-yl)propanoic acid
- English name
- 4-methylthiazole-5-propionic acid
- Molecular formula
- C7H9NO2S
- Molecular weight
- 171.22
Names & synonyms
Einecs 229-284-64-Methyl-5-thiazolepropionic acid4-methylthiazole-5-propionic acid5-Thiazolepropanoic acid, 4-methyl-3-(4-Methyl-5-thiazolyl)propanoic Acid3-(4-Methylthiazol-5-yl)propanoic acid3-(4-methyl-1,3-thiazol-5-yl)propanoic acid3-(4-methyl-1,3-thiazol-5-yl)propanoic acid(SALTDATA: FREE)
Database identifiers
- CAS
6469-32-5- PubChem CID
- 80940
- DTXSID
DTXSID60214989- UNII
- QVN6YGK7M5
- EC Number
- 229-284-6
- Nikkaji
- J225.134E
Properties
Physicochemical properties
- Melting point
- 179 · 179-179.5 °C
- Boiling point
- 323.5 · 323.5±27.0 °C(Predicted)
- Density
- 1.293 · 1.293±0.06 g/cm3(Predicted)
- pka
- 4.41 · 4.41±0.10(Predicted)
- form
- solid
- InChI
- 1S/C7H9NO2S/c1-5-6(11-4-8-5)2-3-7(9)10/h4H,2-3H2,1H3,(H,9,10)
- InChIKey
- HPMBMJNAPIPXFK-UHFFFAOYSA-N
- SMILES
- O=C(O)CCC1=C(C)N=CS1
- FDA UNII
- 6 YGK7M5 · QVN6YGK7M5
- UNSPSC Code
- 12352106 · 12352106
- WGK Germany
- 3 · 3
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Suppliers7 total
韶远科技(上海)有限公司4000665055 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Aladdin Scientific[email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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