butyl thioglycolate (CAS 10047-28-6) — formula C6H12O2S, molecular weight 148.23; category organic chemicals.
butyl thioglycolate is a carbon-based organic compound with CAS registry number 10047-28-6 and molecular formula C6H12O2S (molecular weight 148.23), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 10047-28-6
Its molecular formula C6H12O2S comprises 6 C, 12 H, 2 O, 1 S atoms.
Also known as: butyl thioglycolate
Category: organic chemicals
The CAS registry number of butyl thioglycolate is 10047-28-6.
Molecular formula C6H12O2S, molecular weight 148.23.
It is also registered under: butyl thioglycolate.
Category: Organic Chemicals.
Public-database records for butyl thioglycolate (CAS 10047-28-6), reproduced here for independent cross-checking.
| Reported hazard statements | H301 (97.6%), H311 (97.6%), H331 (97.6%) |
|---|
H301 (97.6%): Toxic if swallowed [Danger Acute toxicity, oral]
H311 (97.6%): Toxic in contact with skin [Danger Acute toxicity, dermal]
| Regulatory & Food Contact | CIR / INCI: Cosmetic ingredients (Butyl Thioglycolate) -> CIR (Cosmetic Ingredient Review) CIR / INCI: Hair waving or straightening |
|---|
| CAS Registry Number | 10047-28-6 |
|---|---|
| PubChem CID | 82321 |
| 分子式 | C6H12O2S |
| IUPAC 名称 | butyl 2-sulfanylacetate |
| UNII（FDA） | 96L21ZJ8JC |
Butyl thioglycolate; 10047-28-6; Butyl mercaptoacetate; Butyl 2-mercaptoacetate; Acetic acid, 2-mercapto-, butyl ester; Acetic acid, mercapto-, butyl ester; 96L21ZJ8JC; EINECS 233-156-5; NSC 65453; NSC-65453; AI3-63085; DTXSID4064929; THIOGLYCOLIC ACID N-BUTYL ESTE; RefChem:571789; DTXCID9032535; BUTYL THIOGLYCOLATE [INCI]
| 分子量 | 148.23 |
|---|---|
| XLogP3 | 1.7 |
| 氢键供体数 | 1 |
| 氢键受体数 | 3 |
| 可旋转键数 | 5 |
| 精确质量 | 148.05580079 |
| 单同位素质量 | 148.05580079 |
| 拓扑极性表面积 | 27.3 |
| 重原子数 | 9 |
| 形式电荷 | 0 |
butyl thioglycolate · CAS 10047-28-6 · C6H12O2S. UNII 96L21ZJ8JC.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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