4-ETHOXYCARBONYLPHENYL ISOTHIOCYANATE (CAS 1205-06-7) — formula C10H9NO2S, molecular weight 207.25; category organic chemicals.
| CAS Number | 1205-06-7 |
|---|---|
| Molecular Formula | C10H9NO2S |
| Molecular Weight | 207.25 |
| LogP | 4.2 |
| Category | Organic Chemicals |
4-ETHOXYCARBONYLPHENYL ISOTHIOCYANATE is a carbon-based organic compound with CAS registry number 1205-06-7 and molecular formula C10H9NO2S (molecular weight 207.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1205-06-7
Its molecular formula C10H9NO2S comprises 10 C, 9 H, 1 N, 2 O, 1 S atoms.
Also known as: 4-ETHOXYCARBONYLPHENYL ISOTHIOCYANATE · 4-(乙氧羰基)苯基硫代异氰酸酯, 97%
Category: organic chemicals
The CAS registry number of 4-ETHOXYCARBONYLPHENYL ISOTHIOCYANATE is 1205-06-7.
Molecular formula C10H9NO2S, molecular weight 207.25.
It is also registered under: 4-ETHOXYCARBONYLPHENYL ISOTHIOCYANATE, 4-(乙氧羰基)苯基硫代异氰酸酯, 97%.
Category: Organic Chemicals.
Independent reference data for 4-ETHOXYCARBONYLPHENYL ISOTHIOCYANATE (CAS 1205-06-7), compiled from public chemistry databases.
| CAS 号 | 1205-06-7 |
|---|---|
| PubChem CID | 71003 |
| 分子式 | C10H9NO2S |
| IUPAC 名称 | ethyl 4-isothiocyanatobenzoate |
| UNII（FDA） | DAD6E3AV3V |
| Molecular Weight | 207.25 |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 207.03539970 |
| Monoisotopic Mass | 207.03539970 |
| Topological Polar Surface Area | 70.8 |
| Heavy Atom Count | 14 |
Ethyl 4-isothiocyanatobenzoate; 1205-06-7; Benzoic acid, 4-isothiocyanato-, ethyl ester; EINECS 214-880-0; DTXSID80152879; NSC 294821; RefChem:138774; DTXCID4075370; 214-880-0; InChI=1/C10H9NO2S/c1-2-13-10(12)8-3-5-9(6-4-8)11-7-14/h3-6H,2H2,1H; 4-Ethoxycarbonylphenyl isothiocyanate; 4-Ethoxycarbonylphenylisothiocyanate; 4-(ethoxycarbonyl)phenyl isothiocyanate; MFCD00022058; 4-Isothiocyanatobenzoic acid ethyl ester; ethyl p-isothiocyanatobenzoate
| 已通报的危害声明 | H302 (100%), H312 (100%), H314 (97.8%), H332 (100%) |
|---|
4-(乙氧羰基)苯基硫代异氰酸酯, 97% · CAS 1205-06-7 · C10H9NO2S. UNII DAD6E3AV3V.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-(乙氧羰基)苯基硫代异氰酸酯, 97%