4-Bromophenyl isothiocyanate
- CAS No.
- 1985-12-2
- Chemical Name:
- 4-Bromophenyl isothiocyanate
- Synonyms
- 1-BROMO-4-ISOTHIOCYANATOBENZENE;Trichofytocid;P-BROMOPHENYL ISOTHIOCYANATE;4-Bromophenyl isothiocyanate;Phenylisothiocyanate, 4-bromo;Bromobenzene-4-isothiocyanate;4-BromophenylIsothiocyanate>4-Bromophenyl isothiocyate, 98%;4-Bromophenyl isothiocyanate,98%;4-Bromophenyl isothiocyanate-97%
- CBNumber:
- CB3396830
- Molecular Formula:
- C7H4BrNS
- Molecular Weight:
- 214.08
- MDL Number:
- MFCD00004808
- MOL File:
- 1985-12-2.mol
- MSDS File:
- SDS
| Melting point | 56-58 °C (lit.) |
|---|---|
| Boiling point | 144-145 °C (5 mmHg) |
| Density | 1.7158 (rough estimate) |
| refractive index | 1.6070 (estimate) |
| Flash point | >110°C |
| storage temp. | Refrigerator (+4°C) |
| form | powder to crystal |
| color | White to Orange to Green |
| Water Solubility | 11.56mg/L(25 ºC) |
| Sensitive | Moisture Sensitive |
| BRN | 878549 |
| InChI | 1S/C7H4BrNS/c8-6-1-3-7(4-2-6)9-5-10/h1-4H |
| InChIKey | XQACWEBGSZBLRG-UHFFFAOYSA-N |
| SMILES | Brc1ccc(cc1)N=C=S |
| CAS DataBase Reference | 1985-12-2(CAS DataBase Reference) |
| EWG's Food Scores | 1 |
| FDA UNII | RIT5DF1B5G |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
SAFETY
Risk and Safety Statements
| Symbol(GHS) | ![]() ![]() ![]() ![]() GHS07,GHS08,GHS05,GHS06 |
|||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Danger | |||||||||
| Hazard statements | H302-H312-H314-H318-H331-H302+H312+H332-H315-H319-H334-H335 | |||||||||
| Precautionary statements | P303+P361+P353-P309-P310-P261-P280-P305+P351+P338-P342+P311 | |||||||||
| target organs | Respiratory system | |||||||||
| PPE | dust mask type N95 (US), Eyeshields, Faceshields, Gloves | |||||||||
| Hazard Codes | Xn,Xi,C | |||||||||
| Risk Statements | 20/21/22-36/37/38-42 | |||||||||
| Safety Statements | 22-26-36/37-45 | |||||||||
| RIDADR | 2811 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | NX8400000 | |||||||||
| F | 10-21 | |||||||||
| Hazard Note | Harmful/Irritant | |||||||||
| HazardClass | 6.1 | |||||||||
| PackingGroup | III | |||||||||
| HS Code | 29309090 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Resp. Sens. 1 Skin Irrit. 2 STOT SE 3 |
|||||||||
| NFPA 704 |
|
4-Bromophenyl isothiocyanate price More Price(25)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| TCI Chemical | I0526 | 4-Bromophenyl Isothiocyanate >98.0%(GC) | 1985-12-2 | 5g | $177 | 2026-04-30 | Buy |
| TCI Chemical | I0526 | 4-Bromophenyl Isothiocyanate >98.0%(GC) | 1985-12-2 | 25g | $595 | 2026-04-30 | Buy |
| Apolloscientific | OR3082 | 4-Bromophenyl isothiocyanate 97% | 1985-12-2 | 1g | $21 | 2026-06-04 | Buy |
| Apolloscientific | OR3082 | 4-Bromophenyl isothiocyanate 97% | 1985-12-2 | 5g | $32 | 2026-06-04 | Buy |
| Apolloscientific | OR3082 | 4-Bromophenyl isothiocyanate 97% | 1985-12-2 | 25g | $98 | 2026-06-04 | Buy |
4-Bromophenyl isothiocyanate Chemical Properties, Uses, Production
Chemical Properties
white to light yellow crystalline powder
Uses
4-Bromophenyl isothiocyanate was used in the synthesis of 1-(4-bromophenyl)-3-ethyl-(1,2-dideoxy-D-glycero-α-D-galacto-heptofurano)[2,1-d]imidazolidine-2-thione.
Purification Methods
Recrystallise the isothiocyanate from boiling n-hexane. Any insoluble material is most probably the corresponding urea. It is also purified by steam distillation, cool the receiver, add NaCl and extract in Et2O, wash the extract with N H2SO4, dry (MgSO4), evaporate and recrystallise the residual solid. [Cymerman-Craig et al. Org Synth Coll Vol IV 700 1963, cf Dains et al. Org Synth Coll Vol I 447 1941, Beilstein 6 IV 1051, 12 II 354, 12 III 1463p, 12 IV 1519.]
4-Bromophenyl isothiocyanate Preparation Products And Raw materials
Raw materials
Preparation Products
| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| J & K SCIENTIFIC LTD. | 18210857532 18210857532 | jkinfo@jkchemical.com | China | 96815 | 76 |
| Meryer (Shanghai) Chemical Technology Co., Ltd. | 4006356688 18621169109 | market03@meryer.com | China | 40202 | 62 |
| Alfa Aesar | 400-6106006 | saleschina@alfa-asia.com | China | 30103 | 84 |
| TCI (Shanghai) Development Co., Ltd. | 021-67121386 | Sales-CN@TCIchemicals.com | China | 24512 | 81 |
| Energy Chemical | 400-0056266 | sales8178@energy-chemical.com | China | 44852 | 61 |
| Shanghai Sinch Parmaceuticals Tech. Co. Ltd. | +86-21-54098501 | sales@sinch.com.cn | China | 11592 | 64 |
| Shanghai Hanhong Scientific Co.,Ltd. | 021-54306202 13764082696 | info@hanhongsci.com | China | 42917 | 64 |
| Shandong Xiya Chemical Co., Ltd | 13355009207 13355009207 | 3007715519@qq.com | China | 18722 | 57 |
| Beijing Taiya Jie Technology Development Co., Ltd. | 021-33690831-8001 13552411790;18616022633 | postmaster@tyjchem.cn | China | 1541 | 55 |
| Thermo Fisher Scientific | 800-810-5118 | cnchemical@thermofisher.com | China | 17752 | 75 |
View Latest Price from 4-Bromophenyl isothiocyanate manufacturers
| Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
|---|---|---|---|---|---|---|---|---|
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2026-02-02 | 4-Bromophenyl isothiocyanate
1985-12-2
|
10mg | 99%HPLC | 2000tons | Shaanxi Dideu Medichem Co. Ltd |
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- 4-Bromophenyl isothiocyanate
1985-12-2
- 99%HPLC
- Shaanxi Dideu Medichem Co. Ltd
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