Benzoic acid, 2-Mercapto-, 1,1-diMethylethyl ester (CAS 96630-12-5) — formula C11H14O2S, molecular weight 210.29; category organic chemicals.
| CAS Number | 96630-12-5 |
|---|---|
| Molecular Formula | C11H14O2S |
| Molecular Weight | 210.29 |
| LogP | 3.7 |
| Category | Organic Chemicals |
Benzoic acid, 2-Mercapto-, 1,1-diMethylethyl ester is a carbon-based organic compound with CAS registry number 96630-12-5 and molecular formula C11H14O2S (molecular weight 210.29), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96630-12-5
Its molecular formula C11H14O2S comprises 11 C, 14 H, 2 O, 1 S atoms.
Also known as: Benzoic acid, 2-Mercapto-, 1,1-diMethylethyl ester · 苯甲酸，2-巯基-，1,1-二甲基乙酯
Category: organic chemicals
The CAS registry number of Benzoic acid, 2-Mercapto-, 1,1-diMethylethyl ester is 96630-12-5.
Molecular formula C11H14O2S, molecular weight 210.29.
It is also registered under: Benzoic acid, 2-Mercapto-, 1,1-diMethylethyl ester, 苯甲酸，2-巯基-，1,1-二甲基乙酯.
Category: Organic Chemicals.
Independent reference data for Benzoic acid, 2-Mercapto-, 1,1-diMethylethyl ester (CAS 96630-12-5), compiled from public chemistry databases.
| CAS 号 | 96630-12-5 |
|---|---|
| PubChem CID | 20028970 |
| 分子式 | C11H14O2S |
| IUPAC 名称 | tert-butyl 2-sulfanylbenzoate |
| Molecular Weight | 210.29 |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 210.07145086 |
| Monoisotopic Mass | 210.07145086 |
| Topological Polar Surface Area | 27.3 |
| Heavy Atom Count | 14 |
tert-butyl 2-mercaptobenzoate; tert-butyl 2-sulfanylbenzoate; t-butyl 2-mercaptobenzoate; t-butyl-2-mercaptobenzoate; 96630-12-5; SCHEMBL10547934; JCJCAEFVDYJKKI-UHFFFAOYSA-N; AKOS040806485
苯甲酸，2-巯基-，1,1-二甲基乙酯 · CAS 96630-12-5 · C11H14O2S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 苯甲酸，2-巯基-，1,1-二甲基乙酯