4-METHOXYCARBONYLPHENYL ISOTHIOCYANATE (CAS 3662-78-0) — formula C9H7NO2S, molecular weight 193.22; category organic chemicals.
| CAS Number | 3662-78-0 |
|---|---|
| Molecular Formula | C9H7NO2S |
| Molecular Weight | 193.22 |
| LogP | 3.8 |
| Category | Organic Chemicals |
4-METHOXYCARBONYLPHENYL ISOTHIOCYANATE is a carbon-based organic compound with CAS registry number 3662-78-0 and molecular formula C9H7NO2S (molecular weight 193.22), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 3662-78-0
Its molecular formula C9H7NO2S comprises 9 C, 7 H, 1 N, 2 O, 1 S atoms.
Also known as: 4-METHOXYCARBONYLPHENYL ISOTHIOCYANATE · 4-甲氧基羰基苯基异硫氰酸酯, 98+%
Category: organic chemicals
The CAS registry number of 4-METHOXYCARBONYLPHENYL ISOTHIOCYANATE is 3662-78-0.
Molecular formula C9H7NO2S, molecular weight 193.22.
It is also registered under: 4-METHOXYCARBONYLPHENYL ISOTHIOCYANATE, 4-甲氧基羰基苯基异硫氰酸酯, 98+%.
Category: Organic Chemicals.
Independent reference data for 4-METHOXYCARBONYLPHENYL ISOTHIOCYANATE (CAS 3662-78-0), compiled from public chemistry databases.
| CAS 号 | 3662-78-0 |
|---|---|
| PubChem CID | 138002 |
| 分子式 | C9H7NO2S |
| IUPAC 名称 | methyl 4-isothiocyanatobenzoate |
| UNII（FDA） | ST50532779 |
| Molecular Weight | 193.22 |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 193.01974964 |
| Monoisotopic Mass | 193.01974964 |
| Topological Polar Surface Area | 70.8 |
| Heavy Atom Count | 13 |
4-Methoxycarbonylphenyl isothiocyanate; 3662-78-0; DTXSID80190094; RefChem:99638; DTXCID90112585; WIZODHILGBTPPA-UHFFFAOYSA-N; Methyl 4-isothiocyanatobenzoate; Benzoic acid, 4-isothiocyanato-, methyl ester; MFCD00041099; 4-isothiocyanatobenzoic acid methyl ester; Methyl p-isothiocyanatobenzoate; SCHEMBL1421354; Methyl 4-isothiocyanatobenzoate #; DAA66278; GEO-01676; p-methoxycarbonylphenyl isothiocyanate
| 已通报的危害声明 | H302 (87.5%), H312 (87.5%), H314 (75%), H315 (12.5%), H317 (12.5%), H319 (12.5%), H331 (75%), H332 (12.5%) |
|---|
4-甲氧基羰基苯基异硫氰酸酯, 98+% · CAS 3662-78-0 · C9H7NO2S. UNII ST50532779.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-甲氧基羰基苯基异硫氰酸酯, 98+%