| Identification | More | [Name]
3-BROMOPHENYL ISOTHIOCYANATE | [CAS]
2131-59-1 | [Synonyms]
3-BROMOPHENYL ISOTHIOCYANATE
ISOTHIOCYANIC ACID 3-BROMOPHENYL ESTER
M-BROMOPHENYL ISOTHIOCYANATE
1-bromo-3-isothiocyanato-benzen
1-Bromo-3-isothiocyanatobenzene
Benzene, 1-bromo-3-isothiocyanato-
Isothiocyanic acid, m-bromophenyl ester
isothiocyanicacid,m-bromophenylester
3-BROMOPHENYL ISOTHIOCYANATE 97% | [EINECS(EC#)]
210-753-9 | [Molecular Formula]
C7H4BrNS | [MDL Number]
MFCD00004803 | [Molecular Weight]
214.08 | [MOL File]
2131-59-1.mol |
| Chemical Properties | Back Directory | [Appearance]
yellow liquid after melting | [Melting point ]
26 °C | [Boiling point ]
256 °C | [density ]
1.50 | [refractive index ]
1.685
| [Fp ]
>110°C | [form ]
powder to crystal | [color ]
White to Almost white | [Water Solubility ]
24.41mg/L(25 ºC) | [Sensitive ]
Moisture Sensitive | [BRN ]
2081173 | [InChI]
1S/C7H4BrNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H | [InChIKey]
ZMGMGHNOACSMQN-UHFFFAOYSA-N | [SMILES]
Brc1cccc(c1)N=C=S | [CAS DataBase Reference]
2131-59-1(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn,C | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R42:May cause sensitization by inhalation. | [Safety Statements ]
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37:Wear suitable protective clothing and gloves .
S22:Do not breathe dust . | [RIDADR ]
2810 | [WGK Germany ]
3 | [RTECS ]
NX8350000 | [HazardClass ]
6.1 | [PackingGroup ]
III | [HS Code ]
29309099 | [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 | [Toxicity]
mouse,LD50,intravenous,56mg/kg (56mg/kg),U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01285, |
| Hazard Information | Back Directory | [Chemical Properties]
yellow liquid after melting | [Uses]
3-Bromophenyl isothiocyanate has been used in the synthesis of:
- (S)-N-[3-{N-(3-bromophenyl)-4-(3-fluorophenyl)piperazine]-1-carbothioamido}-2-oxooxazolidin-5-yl)methyl]acetamide
- (S)-N-[3-{N-(3-bromophenyl)-4-(3-fluorophenyl)piperazine]-1-carboxyamido}-2-oxooxazolidin-5-yl)methyl]acetamide
- (S)-N-[3-{N-(2-bromophenyl)-4-(3-fluorophenyl)piperazine]-1-carboxyamido}-2-oxooxazolidin-5-yl)methyl]acetamide
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| Company Name: |
J & K SCIENTIFIC LTD.
|
| Telephone: |
18210857532 18210857532 |
| Website: |
https://www.jkchemical.com |
| Company Name: |
Alfa Aesar
|
| Telephone: |
400-6106006 |
| Website: |
http://chemicals.thermofisher.cn |
| Company Name: |
Energy Chemical
|
| Telephone: |
400-0056266 |
| Website: |
www.energy-chemical.com |
|