4-CHLOROPHENYL ISOTHIOCYANATE (CAS 2131-55-7) — formula C7H4ClNS, molecular weight 169.63; category organic chemicals.
| CAS Number | 2131-55-7 |
|---|---|
| Molecular Formula | C7H4ClNS |
| Molecular Weight | 169.63 |
| LogP | 3.91 |
| Category | Organic Chemicals |
4-CHLOROPHENYL ISOTHIOCYANATE is a carbon-based organic compound with CAS registry number 2131-55-7 and molecular formula C7H4ClNS (molecular weight 169.63), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2131-55-7
Its molecular formula C7H4ClNS comprises 7 C, 4 H, 1 Cl, 1 N, 1 S atoms.
Also known as: 4-CHLOROPHENYL ISOTHIOCYANATE · 4-氯异硫氰酸苯酯
Category: organic chemicals
The CAS registry number of 4-CHLOROPHENYL ISOTHIOCYANATE is 2131-55-7.
Molecular formula C7H4ClNS, molecular weight 169.63.
It is also registered under: 4-CHLOROPHENYL ISOTHIOCYANATE, 4-氯异硫氰酸苯酯.
Category: Organic Chemicals.
Independent reference data for 4-CHLOROPHENYL ISOTHIOCYANATE (CAS 2131-55-7), compiled from public chemistry databases.
| CAS 号 | 2131-55-7 |
|---|---|
| PubChem CID | 16480 |
| 分子式 | C7H4ClNS |
| IUPAC 名称 | 1-chloro-4-isothiocyanatobenzene |
| UNII（FDA） | 393YTR4225 |
| Molecular Weight | 169.63 |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 168.9752980 |
| Monoisotopic Mass | 168.9752980 |
| Topological Polar Surface Area | 44.5 |
| Heavy Atom Count | 10 |
| LogP | 3.91 |
|---|
4-Chlorophenyl isothiocyanate; 2131-55-7; 1-CHLORO-4-ISOTHIOCYANATOBENZENE; p-Chlorophenyl isothiocyanate; Benzene, 1-chloro-4-isothiocyanato-; Sch-20350; NSC-20213; DTXSID70175577; 393YTR4225; RefChem:75421; DTXCID9098068; 218-358-3; 1-chloro-4-isothiocyanato-benzene; 4-Chlorophenylisothiocyanate; Isothiocyanic acid, p-chlorophenyl ester; 4-Chlor-phenyl-isothiocyanat
| 已通报的危害声明 | H301 (89.6%), H311 (89.6%), H315 (91.7%), H317 (87.5%), H319 (91.7%), H331 (91.7%), H334 (89.6%), H335 (91.7%) |
|---|
4-氯异硫氰酸苯酯 · CAS 2131-55-7 · C7H4ClNS. UNII 393YTR4225. LogP: 3.91.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-氯异硫氰酸苯酯