Thiocyanatoacetic acid cyclohexyl ester (CAS 5349-27-9) — formula C9H13NO2S, molecular weight 199.27; category organic chemicals.
| CAS Number | 5349-27-9 |
|---|---|
| Molecular Formula | C9H13NO2S |
| Molecular Weight | 199.27 |
| LogP | 2.7 |
| Category | Organic Chemicals |
Thiocyanatoacetic acid cyclohexyl ester is a carbon-based organic compound with CAS registry number 5349-27-9 and molecular formula C9H13NO2S (molecular weight 199.27), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5349-27-9
Its molecular formula C9H13NO2S comprises 9 C, 13 H, 1 N, 2 O, 1 S atoms.
Also known as: Thiocyanatoacetic acid cyclohexyl ester · 硫氰酸乙酸环己酯
Category: organic chemicals
The CAS registry number of Thiocyanatoacetic acid cyclohexyl ester is 5349-27-9.
Molecular formula C9H13NO2S, molecular weight 199.27.
It is also registered under: Thiocyanatoacetic acid cyclohexyl ester, 硫氰酸乙酸环己酯.
Category: Organic Chemicals.
Independent reference data for Thiocyanatoacetic acid cyclohexyl ester (CAS 5349-27-9), compiled from public chemistry databases.
| CAS 号 | 5349-27-9 |
|---|---|
| PubChem CID | 21445 |
| 分子式 | C9H13NO2S |
| IUPAC 名称 | cyclohexyl 2-thiocyanatoacetate |
| UNII（FDA） | H2NM9K22RG |
| Molecular Weight | 199.27 |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 199.06669983 |
| Monoisotopic Mass | 199.06669983 |
| Topological Polar Surface Area | 75.4 |
| Heavy Atom Count | 13 |
Cyklohexylthiokyanoacetat; ACETIC ACID, THIOCYANATO-, CYCLOHEXYL ESTER; 5349-27-9; Cyklohexylester kyseliny thiokyanooctove; H2NM9K22RG; NSC-1200; Cyklohexylthiokyanoacetat [Czech]; Thiocyanatoacetate cyclohexyl ester; NSC 1200; Cyklohexylester kyseliny thiokyanooctove [Czech]; BRN 3259501; UNII-H2NM9K22RG; WLN: L6TJ AOV1SCN; Cyclohexyl (thiocyanato)acetate; SCHEMBL27674084; DTXSID20201673
硫氰酸乙酸环己酯 · CAS 5349-27-9 · C9H13NO2S. UNII H2NM9K22RG.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 硫氰酸乙酸环己酯