2-mercapto-2-methylpropionic acid (CAS 4695-31-2) — formula C4H8O2S, molecular weight 120.17; category organic chemicals.
| CAS Number | 4695-31-2 |
|---|---|
| Molecular Formula | C4H8O2S |
| Molecular Weight | 120.17 |
| LogP | 0.7 |
| Applications | General Manufacturing Information: Propanoic acid, 2-mercapto-2-methyl-: INACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: Propanoic acid, 2-mercapto-2-methyl-: INACTIVE.
2-mercapto-2-methylpropionic acid is a carbon-based organic compound with CAS registry number 4695-31-2 and molecular formula C4H8O2S (molecular weight 120.17), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4695-31-2
Its molecular formula C4H8O2S comprises 4 C, 8 H, 2 O, 1 S atoms.
Also known as: 2-mercapto-2-methylpropionic acid · 2-巯基-2-甲基丙酸
Category: organic chemicals
The CAS registry number of 2-mercapto-2-methylpropionic acid is 4695-31-2.
Molecular formula C4H8O2S, molecular weight 120.17.
It is also registered under: 2-mercapto-2-methylpropionic acid, 2-巯基-2-甲基丙酸.
Recorded applications: General Manufacturing Information: Propanoic acid, 2-mercapto-2-methyl-: INACTIVE.
Category: Organic Chemicals.
Independent reference data for 2-mercapto-2-methylpropionic acid (CAS 4695-31-2), compiled from public chemistry databases.
| CAS Registry Number | 4695-31-2 |
|---|---|
| PubChem CID | 78421 |
| Molecular formula | C4H8O2S |
| IUPAC name | 2-methyl-2-sulfanylpropanoic acid |
| UNII (FDA) | XT2NW8D545 |
| Molecular Weight | 120.17 |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 120.02450067 |
| Monoisotopic Mass | 120.02450067 |
| Topological Polar Surface Area | 38.3 |
| Heavy Atom Count | 7 |
2-Mercaptoisobutyric acid; 4695-31-2; 2-Mercapto-2-methylpropanoic acid; Mercaptoisobutyric acid; XT2NW8D545; DTXSID6063561; RefChem:474041; DTXCID2040523; 225-159-5; 2-Methyl-2-sulfanylpropanoic acid; Propanoic acid, 2-mercapto-2-methyl-; 2-Mercapto-2-methylpropionic acid; 2-Mercaptoisobutyric Acid, 90%; 2-Mercaptoisobutyricacid; MFCD00797841; EINECS 225-159-5
| Reported hazard statements | H318 (100%) |
|---|
H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
P264+P265, P280, P305+P354+P338, and P317 (click each P-code to see the statement)
2-mercapto-2-methylpropionic acid · CAS 4695-31-2 · C4H8O2S. UNII XT2NW8D545.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2-巯基-2-甲基丙酸