3-Bromobenzyl isothiocyanate (CAS 3845-33-8) — formula C8H6BrNS, molecular weight 228.11; category organic chemicals.
| CAS Number | 3845-33-8 |
|---|---|
| Molecular Formula | C8H6BrNS |
| Molecular Weight | 228.11 |
| LogP | 4.2 |
| Category | Organic Chemicals |
3-Bromobenzyl isothiocyanate is a carbon-based organic compound with CAS registry number 3845-33-8 and molecular formula C8H6BrNS (molecular weight 228.11), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 3845-33-8
Its molecular formula C8H6BrNS comprises 8 C, 6 H, 1 Br, 1 N, 1 S atoms.
Also known as: 3-Bromobenzyl isothiocyanate · 3-溴苄基异硫氰酸酯
Category: organic chemicals
The CAS registry number of 3-Bromobenzyl isothiocyanate is 3845-33-8.
Molecular formula C8H6BrNS, molecular weight 228.11.
It is also registered under: 3-Bromobenzyl isothiocyanate, 3-溴苄基异硫氰酸酯.
Category: Organic Chemicals.
Independent reference data for 3-Bromobenzyl isothiocyanate (CAS 3845-33-8), compiled from public chemistry databases.
| CAS 号 | 3845-33-8 |
|---|---|
| PubChem CID | 10656929 |
| 分子式 | C8H6BrNS |
| IUPAC 名称 | 1-bromo-3-(isothiocyanatomethyl)benzene |
| Molecular Weight | 228.11 |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 226.94043 |
| Monoisotopic Mass | 226.94043 |
| Topological Polar Surface Area | 44.5 |
| Heavy Atom Count | 11 |
1-bromo-3-(isothiocyanatomethyl)benzene; 3845-33-8; DTXSID80443113; RefChem:430421; DTXCID50393934; 101-113-9; Benzene, 1-bromo-3-(isothiocyanatomethyl)-; 3-bromobenzyl isothiocyanate; SCHEMBL2338356; AKOS010670523; DB-252406; EN300-3552023
| 已通报的危害声明 | H302 (100%), H312 (100%), H314 (100%), H317 (100%), H331 (100%), H334 (100%), H335 (100%) |
|---|
3-溴苄基异硫氰酸酯 · CAS 3845-33-8 · C8H6BrNS.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-溴苄基异硫氰酸酯