BENZHYDRYL ISOTHIOCYANATE (CAS 3550-21-8) — formula C14H11NS, molecular weight 225.31; category organic chemicals.
| CAS Number | 3550-21-8 |
|---|---|
| Molecular Formula | C14H11NS |
| Molecular Weight | 225.31 |
| LogP | 5.09 |
| Category | Organic Chemicals |
BENZHYDRYL ISOTHIOCYANATE is a carbon-based organic compound with CAS registry number 3550-21-8 and molecular formula C14H11NS (molecular weight 225.31), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 3550-21-8
Its molecular formula C14H11NS comprises 14 C, 11 H, 1 N, 1 S atoms.
Also known as: BENZHYDRYL ISOTHIOCYANATE · 二苯甲基异硫氰酸盐
Category: organic chemicals
The CAS registry number of BENZHYDRYL ISOTHIOCYANATE is 3550-21-8.
Molecular formula C14H11NS, molecular weight 225.31.
It is also registered under: BENZHYDRYL ISOTHIOCYANATE, 二苯甲基异硫氰酸盐.
Category: Organic Chemicals.
Independent reference data for BENZHYDRYL ISOTHIOCYANATE (CAS 3550-21-8), compiled from public chemistry databases.
| CAS 号 | 3550-21-8 |
|---|---|
| PubChem CID | 520742 |
| 分子式 | C14H11NS |
| IUPAC 名称 | [isothiocyanato(phenyl)methyl]benzene |
| UNII（FDA） | ST50825755 |
| Molecular Weight | 225.31 |
|---|---|
| XLogP3 | 5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 225.06122053 |
| Monoisotopic Mass | 225.06122053 |
| Topological Polar Surface Area | 44.5 |
| Heavy Atom Count | 16 |
| LogP | 5.09 |
|---|
Benzhydryl isothiocyanate; 3550-21-8; DTXSID30334446; RefChem:118129; DTXCID40285536; 625-225-7; WDOSFTZMBFYTED-UHFFFAOYSA-N; [Isothiocyanato(phenyl)methyl]benzene; BENZHYDRylisoTHIOCYANATE; MFCD00046815; CHEMBL3409412; diphenylmethanisothiocyanate; Benzene, 1,1'-(isothiocyanatomethylene)bis-; benzhydryl-isothiocyanate; benzhydryl isothio-cyanate; SCHEMBL1247431
| 已通报的危害声明 | H302 (100%), H312 (100%), H315 (90.9%), H319 (90.9%), H332 (100%), H334 (88.6%), H335 (90.9%) |
|---|
二苯甲基异硫氰酸盐 · CAS 3550-21-8 · C14H11NS. UNII ST50825755. LogP: 5.09.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 二苯甲基异硫氰酸盐