isotridecyl mercaptoacetate (CAS 57417-85-3) — formula C15H30O2S, molecular weight 274.5; category organic chemicals.
| CAS Number | 57417-85-3 |
|---|---|
| Molecular Formula | C15H30O2S |
| Molecular Weight | 274.5 |
| LogP | 6.3 |
| Category | Organic Chemicals |
isotridecyl mercaptoacetate is a carbon-based organic compound with CAS registry number 57417-85-3 and molecular formula C15H30O2S (molecular weight 274.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 57417-85-3
Its molecular formula C15H30O2S comprises 15 C, 30 H, 2 O, 1 S atoms.
Also known as: isotridecyl mercaptoacetate · 巯基乙酸异十三烷基酯
Category: organic chemicals
The CAS registry number of isotridecyl mercaptoacetate is 57417-85-3.
Molecular formula C15H30O2S, molecular weight 274.5.
It is also registered under: isotridecyl mercaptoacetate, 巯基乙酸异十三烷基酯.
Category: Organic Chemicals.
Independent reference data for isotridecyl mercaptoacetate (CAS 57417-85-3), compiled from public chemistry databases.
| CAS Registry Number | 57417-85-3 |
|---|---|
| PubChem CID | 93670 |
| Molecular formula | C15H30O2S |
| IUPAC name | 11-methyldodecyl 2-sulfanylacetate |
| UNII (FDA) | NS00052767 |
| Molecular Weight | 274.5 |
|---|---|
| XLogP3 | 6.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 13 |
| Exact Mass | 274.19665137 |
| Monoisotopic Mass | 274.19665137 |
| Topological Polar Surface Area | 27.3 |
| Heavy Atom Count | 18 |
57417-85-3; Acetic acid, mercapto-, isotridecyl ester; EINECS 260-730-2; Acetic acid, 2-mercapto-, isotridecyl ester; RefChem:108951; Isotridecyl thioglycolate; Isotridecyl mercaptoacetate; 137754-72-4; 11-methyldodecyl 2-sulfanylacetate; 11-methyldodecyl sulfanylacetate; SCHEMBL20483674; DTXSID90972904; HYBIDFUUNHAJDS-UHFFFAOYSA-N; 11-Methyldodecyl 2-mercaptoacetate; Mercapto-acetic acid isotridecylester; DB-255118
| Reported hazard statements | H301 (99%), H317 (99%) |
|---|
H301 (99%): Toxic if swallowed [Danger Acute toxicity, oral]
H317 (99%): May cause an allergic skin reaction [Warning Sensitization, Skin]
isotridecyl mercaptoacetate · CAS 57417-85-3 · C15H30O2S. UNII NS00052767.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 巯基乙酸异十三烷基酯