ChemicalBook--->CAS DataBase List--->458-05-9

458-05-9

458-05-9 Structure

458-05-9 Structure
IdentificationMore
[Name]

1-(3-FLUOROPHENYL)-2-THIOUREA
[CAS]

458-05-9
[Synonyms]

1-(3-FLUOROPHENYL)-2-THIOUREA
3-FLUOROPHENYLTHIOUREA
SALOR-INT L479020-1EA
3-Fluorophenylthiourea,99%
1-(3-Fluorophenyl)-2-thiourea98%
1-(m-Fluorophenyl)thiourea
[Molecular Formula]

C7H7FN2S
[MDL Number]

MFCD00041167
[Molecular Weight]

170.21
[MOL File]

458-05-9.mol
Chemical PropertiesBack Directory
[Appearance]

almost white fine crystalline powder
[Melting point ]

114-117 °C (lit.)
[Boiling point ]

259.3±42.0 °C(Predicted)
[density ]

1.397±0.06 g/cm3(Predicted)
[form ]

solid
[pka]

12.61±0.70(Predicted)
[BRN ]

2718454
[InChI]

1S/C7H7FN2S/c8-5-2-1-3-6(4-5)10-7(9)11/h1-4H,(H3,9,10,11)
[InChIKey]

YKOBLHQALWQKTC-UHFFFAOYSA-N
[SMILES]

NC(=S)Nc1cccc(F)c1
[CAS DataBase Reference]

458-05-9(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

T,Xi
[Risk Statements ]

R25:Toxic if swallowed.
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 .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

UN 2811 6.1/PG 3
[WGK Germany ]

3
[Hazard Note ]

Toxic
[HazardClass ]

6.1
[PackingGroup ]

II
[HS Code ]

29309090
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

almost white fine crystalline powder
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1-(3-Fluorophenyl)-2-thiourea, 98%(458-05-9)
[Alfa Aesar]

N-(3-Fluorophenyl)thiourea, 99%(458-05-9)
[Sigma Aldrich]

458-05-9(sigmaaldrich)
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