3-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE (CAS 1840-19-3) — formula C8H4F3NS, molecular weight 203.19; category organic chemicals.
| CAS Number | 1840-19-3 |
|---|---|
| Molecular Formula | C8H4F3NS |
| Molecular Weight | 203.19 |
| LogP | 4.7 |
| Category | Organic Chemicals |
3-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE is a carbon-based organic compound with CAS registry number 1840-19-3 and molecular formula C8H4F3NS (molecular weight 203.19), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1840-19-3
Its molecular formula C8H4F3NS comprises 8 C, 4 H, 3 F, 1 N, 1 S atoms.
Also known as: 3-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE · 阿尔法,阿尔法,阿尔法位-三氟-间-甲苯异硫氰
Category: organic chemicals
The CAS registry number of 3-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE is 1840-19-3.
Molecular formula C8H4F3NS, molecular weight 203.19.
It is also registered under: 3-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE, 阿尔法,阿尔法,阿尔法位-三氟-间-甲苯异硫氰.
Category: Organic Chemicals.
Independent reference data for 3-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE (CAS 1840-19-3), compiled from public chemistry databases.
| CAS 号 | 1840-19-3 |
|---|---|
| PubChem CID | 137232 |
| 分子式 | C8H4F3NS |
| IUPAC 名称 | 1-isothiocyanato-3-(trifluoromethyl)benzene |
| UNII（FDA） | HMS1786G12 |
| Molecular Weight | 203.19 |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 203.00165479 |
| Monoisotopic Mass | 203.00165479 |
| Topological Polar Surface Area | 44.5 |
| Heavy Atom Count | 13 |
3-(Trifluoromethyl)phenyl isothiocyanate; 1840-19-3; 1-Isothiocyanato-3-(trifluoromethyl)benzene; GFEPANUKFYVALF-UHFFFAOYSA-; DTXSID90171531; RefChem:433400; DTXCID5094022; 628-756-2; InChI=1/C8H4F3NS/c9-8(10,11)6-2-1-3-7(4-6)12-5-13/h1-4H; 3-(trifluoromethyl)phenylisothiocyanate; MFCD00004806; Benzene, 1-isothiocyanato-3-(trifluoromethyl)-; m-(Trifluoromethyl)phenyl isothiocyanate; 3-trifluoromethylphenyl isothiocyanate; alpha,alpha,alpha-Trifluoro-m-tolyl isothiocyanate; 1-isothiocyanato-3-trifluoromethyl-benzene
| 已通报的危害声明 | H302 (95.7%), H312 (95.7%), H314 (97.9%), H318 (85.1%), H332 (95.7%), H335 (87.2%) |
|---|
阿尔法,阿尔法,阿尔法位-三氟-间-甲苯异硫氰 · CAS 1840-19-3 · C8H4F3NS. UNII HMS1786G12.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 阿尔法,阿尔法,阿尔法位-三氟-间-甲苯异硫氰