2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL ISOCYANATE (CAS 50528-86-4) — formula C8H3ClF3NO, molecular weight 221.56; category organic chemicals.
| CAS Number | 50528-86-4 |
|---|---|
| Molecular Formula | C8H3ClF3NO |
| Molecular Weight | 221.56 |
| LogP | 4.2 |
| Category | Organic Chemicals |
2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL ISOCYANATE is a carbon-based organic compound with CAS registry number 50528-86-4 and molecular formula C8H3ClF3NO (molecular weight 221.56), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 50528-86-4
Its molecular formula C8H3ClF3NO comprises 8 C, 3 H, 1 Cl, 3 F, 1 N, 1 O atoms.
Also known as: 2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL ISOCYANATE · 异氰酸- 2-氯-5-(三氟甲基)苯酯
Category: organic chemicals
The CAS registry number of 2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL ISOCYANATE is 50528-86-4.
Molecular formula C8H3ClF3NO, molecular weight 221.56.
It is also registered under: 2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL ISOCYANATE, 异氰酸- 2-氯-5-(三氟甲基)苯酯.
Category: Organic Chemicals.
Independent reference data for 2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL ISOCYANATE (CAS 50528-86-4), compiled from public chemistry databases.
| CAS 号 | 50528-86-4 |
|---|---|
| PubChem CID | 2733263 |
| 分子式 | C8H3ClF3NO |
| IUPAC 名称 | 1-chloro-2-isocyanato-4-(trifluoromethyl)benzene |
| UNII（FDA） | ST50825724 |
| Molecular Weight | 221.56 |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 220.9855259 |
| Monoisotopic Mass | 220.9855259 |
| Topological Polar Surface Area | 29.4 |
| Heavy Atom Count | 14 |
50528-86-4; 1-chloro-2-isocyanato-4-(trifluoromethyl)benzene; RefChem:431228; 625-594-4; 2-Chloro-5-(trifluoromethyl)phenyl isocyanate; Isocyanic Acid 2-Chloro-5-(trifluoromethyl)phenyl Ester; MFCD00037029; SCHEMBL58769; DTXSID50369816; BBL037675; GEO-00820; AKOS005171112; SY049940; VS-14361; 2-chloro-5-trifluoromethylphenyl isocyanate; 2-Chloro-5-(trifluoromethyl)phenyl isocyanate, 97%
| 已通报的危害声明 | H302 (97.8%), H312 (89.1%), H315 (100%), H319 (100%), H331 (10.9%), H332 (89.1%), H334 (17.4%), H335 (100%) |
|---|
异氰酸- 2-氯-5-(三氟甲基)苯酯 · CAS 50528-86-4 · C8H3ClF3NO. UNII ST50825724.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 异氰酸- 2-氯-5-(三氟甲基)苯酯