3-(dodecylthio)butyronitrile (CAS 93918-85-5) — formula C16H31NS, molecular weight 269.5; category organic chemicals.
| CAS Number | 93918-85-5 |
|---|---|
| Molecular Formula | C16H31NS |
| Molecular Weight | 269.5 |
| LogP | 6.6 |
| Category | Organic Chemicals |
3-(dodecylthio)butyronitrile is a carbon-based organic compound with CAS registry number 93918-85-5 and molecular formula C16H31NS (molecular weight 269.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 93918-85-5
Its molecular formula C16H31NS comprises 16 C, 31 H, 1 N, 1 S atoms.
Also known as: 3-(dodecylthio)butyronitrile · 3-(十二烷硫基)丁腈
Category: organic chemicals
The CAS registry number of 3-(dodecylthio)butyronitrile is 93918-85-5.
Molecular formula C16H31NS, molecular weight 269.5.
It is also registered under: 3-(dodecylthio)butyronitrile, 3-(十二烷硫基)丁腈.
Category: Organic Chemicals.
Independent reference data for 3-(dodecylthio)butyronitrile (CAS 93918-85-5), compiled from public chemistry databases.
| CAS 号 | 93918-85-5 |
|---|---|
| PubChem CID | 3022901 |
| 分子式 | C16H31NS |
| IUPAC 名称 | 3-dodecylsulfanylbutanenitrile |
| UNII（FDA） | NS00001397 |
| Molecular Weight | 269.5 |
|---|---|
| XLogP3 | 6.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 13 |
| Exact Mass | 269.21772117 |
| Monoisotopic Mass | 269.21772117 |
| Topological Polar Surface Area | 49.1 |
| Heavy Atom Count | 18 |
3-(Dodecylthio)butyronitrile; EINECS 299-966-6; EC 299-966-6; RefChem:495132; 299-966-6; 93918-85-5; 3-(DODECYLSULFANYL)BUTANENITRILE; SCHEMBL8895842; DTXSID40917143; LWJYQMDILSTVNM-UHFFFAOYSA-N; NS00001397
| 已通报的危害声明 | H226 (100%), H411 (50%) |
|---|
3-(十二烷硫基)丁腈 · CAS 93918-85-5 · C16H31NS. UNII NS00001397.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-(十二烷硫基)丁腈