4-NITROBENZYL THIOCYANATE (CAS 13287-49-5) — formula C8H6N2O2S, molecular weight 194.21; category organic chemicals.
| CAS Number | 13287-49-5 |
|---|---|
| Molecular Formula | C8H6N2O2S |
| Molecular Weight | 194.21 |
| LogP | 2.6 |
| Category | Organic Chemicals |
4-NITROBENZYL THIOCYANATE is a carbon-based organic compound with CAS registry number 13287-49-5 and molecular formula C8H6N2O2S (molecular weight 194.21), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 13287-49-5
Its molecular formula C8H6N2O2S comprises 8 C, 6 H, 2 N, 2 O, 1 S atoms.
Also known as: 4-NITROBENZYL THIOCYANATE · 4-硝基硫氰酸苄酯
Category: organic chemicals
The CAS registry number of 4-NITROBENZYL THIOCYANATE is 13287-49-5.
Molecular formula C8H6N2O2S, molecular weight 194.21.
It is also registered under: 4-NITROBENZYL THIOCYANATE, 4-硝基硫氰酸苄酯.
Category: Organic Chemicals.
Independent reference data for 4-NITROBENZYL THIOCYANATE (CAS 13287-49-5), compiled from public chemistry databases.
| CAS 号 | 13287-49-5 |
|---|---|
| PubChem CID | 83306 |
| 分子式 | C8H6N2O2S |
| IUPAC 名称 | (4-nitrophenyl)methyl thiocyanate |
| UNII（FDA） | NS00024244 |
| Molecular Weight | 194.21 |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 194.01499861 |
| Monoisotopic Mass | 194.01499861 |
| Topological Polar Surface Area | 94.9 |
| Heavy Atom Count | 13 |
(4-nitrophenyl)methyl thiocyanate; p-Nitrobenzyl thiocyanate; RefChem:858143; 236-299-1; 4-Nitrobenzyl thiocyanate; 13287-49-5; 1-Nitro-4-(thiocyanatomethyl)benzene; Thiocyanic acid, (4-nitrophenyl)methyl ester; Thiocyanic acid, 4-nitrobenzyl ester; Thiocyanic acid, (p-nitrobenzyl) ester; p-Nitrobenzylthiocyanate; MFCD00024784; 4-Nitrobenzylthiocyanate; EINECS 236-299-1; NSC 56364; WLN: NCS1R DNW
| 已通报的危害声明 | H302 (100%), H317 (100%) |
|---|
4-硝基硫氰酸苄酯 · CAS 13287-49-5 · C8H6N2O2S. UNII NS00024244.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-硝基硫氰酸苄酯