3-CHLOROPHENYL ISOTHIOCYANATE (CAS 2392-68-9) — formula C7H4ClNS, molecular weight 169.63; category organic chemicals.
| CAS Number | 2392-68-9 |
|---|---|
| Molecular Formula | C7H4ClNS |
| Molecular Weight | 169.63 |
| LogP | 3.36 |
| Category | Organic Chemicals |
3-CHLOROPHENYL ISOTHIOCYANATE is a carbon-based organic compound with CAS registry number 2392-68-9 and molecular formula C7H4ClNS (molecular weight 169.63), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2392-68-9
Its molecular formula C7H4ClNS comprises 7 C, 4 H, 1 Cl, 1 N, 1 S atoms.
Also known as: 3-CHLOROPHENYL ISOTHIOCYANATE · 3-氯异硫氰酸苯酯
Category: organic chemicals
The CAS registry number of 3-CHLOROPHENYL ISOTHIOCYANATE is 2392-68-9.
Molecular formula C7H4ClNS, molecular weight 169.63.
It is also registered under: 3-CHLOROPHENYL ISOTHIOCYANATE, 3-氯异硫氰酸苯酯.
Category: Organic Chemicals.
Independent reference data for 3-CHLOROPHENYL ISOTHIOCYANATE (CAS 2392-68-9), compiled from public chemistry databases.
| CAS 号 | 2392-68-9 |
|---|---|
| PubChem CID | 75449 |
| 分子式 | C7H4ClNS |
| IUPAC 名称 | 1-chloro-3-isothiocyanatobenzene |
| UNII（FDA） | ST50824954 |
| Molecular Weight | 169.63 |
|---|---|
| XLogP3 | 4.1 |
| 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 | 3.36 |
|---|
3-Chlorophenyl isothiocyanate; RefChem:500506; 2392-68-9; 1-Chloro-3-isothiocyanatobenzene; 3-Chlorophenylisothiocyanate; Benzene, 1-chloro-3-isothiocyanato-; Isothiocyanic acid, 3-chlorophenyl ester; 1-Chloro-3-isothiocyanato-benzene; Isothiocyanic acid, m-chlorophenyl ester; MFCD00004805; m-chlorophenyl isothiocyanate; 3-chlorobenzenisothiocyanate; NSC 132371; BRN 0636856; WLN: SCNR CG; 3-12-00-01317 (Beilstein Handbook Reference)
| 已通报的危害声明 | H302 (95.7%), H312 (95.7%), H314 (10.9%), H315 (89.1%), H319 (89.1%), H332 (93.5%), H335 (89.1%) |
|---|
3-氯异硫氰酸苯酯 · CAS 2392-68-9 · C7H4ClNS. UNII ST50824954. LogP: 3.36.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-氯异硫氰酸苯酯