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6320-01-0

6320-01-0 Structure

6320-01-0 Structure
IdentificationMore
[Name]

3-BROMOTHIOPHENOL
[CAS]

6320-01-0
[Synonyms]

3-BROMOBENZENETHIOL
3-BROMOTHIOPHENOL
M-BROMOBENZENETHIOL
3-Bromophenylmercaptan
Benzenethiol, 3-bromo-
m-Bromothiophenol
3-Bromothiophenol 97%
3-Bromothiophenol97%
3-Bromo thiophenol ,98%
[EINECS(EC#)]

228-664-9
[Molecular Formula]

C6H5BrS
[MDL Number]

MFCD00009603
[Molecular Weight]

189.07
[MOL File]

6320-01-0.mol
Chemical PropertiesBack Directory
[Appearance]

clear colourless to light yellow liquid
[Melting point ]

214-215 °C(Solv: isopropanol (67-63-0))
[Boiling point ]

123-124 °C/40 mmHg (lit.)
[density ]

1.832 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.634(lit.)
[Fp ]

105 °C
[storage temp. ]

Refrigerator
[form ]

Crystalline Powder
[pka]

5.83±0.10(Predicted)
[color ]

White to light beige
[Specific Gravity]

1.832
[Sensitive ]

Stench
[Detection Methods]

HPLC
[BRN ]

1926242
[InChI]

1S/C6H5BrS/c7-5-2-1-3-6(8)4-5/h1-4,8H
[InChIKey]

HNGQQUDFJDROPY-UHFFFAOYSA-N
[SMILES]

Sc1cccc(Br)c1
[CAS DataBase Reference]

6320-01-0(CAS DataBase Reference)
[NIST Chemistry Reference]

3-Bromothiophenol(6320-01-0)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[RIDADR ]

2811
[WGK Germany ]

3
[F ]

10-13-23
[Hazard Note ]

Irritant/Stench
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29309090
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

3-Bromoaniline-->Potassium ethylxanthate-->Phenyl acetic acid (powder)
[Preparation Products]

6-Bromo-benzo[b]thiophene-->3-Bromothioanisole-->Ethyl 2-(3-bromophenyl)sulfanylacetate-->1-Bromo-3-(isopropylsulfanyl)benzene-->1-bromo-3-(2-methoxyethylsulfanyl)benzene-->Propanoic acid, 3-[(3-bromophenyl)thio]-
Hazard InformationBack Directory
[Chemical Properties]

clear colourless to light yellow liquid
[Uses]

3-Bromothiophenol has been used in the preparation of:
  • 3-lithium-O-lithiophenoxide
  • bis[(diarylamino)styryl]benzene functionalized with sulfonium groups
Spectrum DetailBack Directory
[Spectrum Detail]

3-BROMOTHIOPHENOL(6320-01-0)MS
3-BROMOTHIOPHENOL(6320-01-0)1HNMR
3-BROMOTHIOPHENOL(6320-01-0)IR1
3-BROMOTHIOPHENOL(6320-01-0)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Bromothiophenol, 95%(6320-01-0)
[Alfa Aesar]

3-Bromothiophenol, 97%(6320-01-0)
[Sigma Aldrich]

6320-01-0(sigmaaldrich)
[TCI AMERICA]

3-Bromobenzenethiol,>98.0%(GC)(6320-01-0)
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