Note Type	Comments	Provided By
Molecular_Solubility	2.998	Bitter DB
BP [°C]	102	Acros Organics
MP	160	TCI
MP	160°	Fluorochem
Melting_Point	202-206?	Alfa-Aesar
Melting_Point	202-206°	Alfa-Aesar
Mp [°C]	243 - 245	Acros Organics
Mp [°C]	285	Acros Organics
Melting_Point	370-380? dec.	Alfa-Aesar
Melting_Point	370-380° dec.	Alfa-Aesar
Mp [°C]	40 - 45	Acros Organics
Purity	95%	Fluorochem
Purity	98%	Fluorochem
Purity	99%	Fluorochem
Boiling_Point	>100?	Alfa-Aesar
Boiling_Point	>100°	Alfa-Aesar
Mp [°C]	>240	Acros Organics
Mp [°C]	>300	Acros Organics
Melting_Point	>300?	Alfa-Aesar
Melting_Point	>300°	Alfa-Aesar
Hazard	C: Corrosive	Acros Organics
Hazard	C: Corrosive; N: Dangerous for the environment	Acros Organics
Melting_Point	ca 110?	Alfa-Aesar
Melting_Point	ca 110°	Alfa-Aesar
Melting_Point	ca 225? dec.	Alfa-Aesar
Melting_Point	ca 225° dec.	Alfa-Aesar
Melting_Point	ca 285? dec.	Alfa-Aesar
Melting_Point	ca 285° dec.	Alfa-Aesar
Melting_Point	ca 320? dec.	Alfa-Aesar
Melting_Point	ca 320° dec.	Alfa-Aesar
Boiling_Point	dec.	Alfa-Aesar
Patent Database Links	EP0841340; EP1010667; EP1666044; GB2010309; US2005171145; US2007207217; WO2005049586; WO2005066122; WO2006029811	ChEBI
Hazard	F: Highly flammable	Acros Organics
UniProt Database Links	GLIC_GLOVI; NCDN_RAT; OCT1_CAEEL; OSCP1_HUMAN; S22A1_BOVIN; S22A1_HUMAN; S22A1_MOUSE; S22A1_PIG; S22A1_RABIT; S22A1_RAT; S22A2_HUMAN; S22A2_MOUSE; S22A2_PIG; S22A2_PONAB; S22A2_RABIT; S22A2_RAT; S22A4_HUMAN; S22A4_MOUSE; S22A4_PAPAN; S22A4_RAT; S22A5_HUMA	ChEBI
H phrase	H228: Flammable solid	Acros Organics
H phrase	H272: May intensify fire; oxidizer	Acros Organics
H phrase	H272: May intensify fire; oxidizer; EUH044: Risk of explosion if heated under confinement	Acros Organics
H phrase	H314: Causes severe skin burns and eye damage	Acros Organics
H phrase	H314: Causes severe skin burns and eye damage; H411: Toxic to aquatic life with long lasting effects	Acros Organics
H phrase	H315: Causes skin irritation	Acros Organics
H phrase	H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation	Acros Organics
H phrase	H315: Causes skin irritation; H335: May cause respiratory irritation; H319: Causes serious eye irritation	Acros Organics
H phrase	H315: Causes skin irritation; H335: May cause respiratory irritation; H319: Causes serious eye irritation; H272: May intensify fire; oxidizer	Acros Organics
H phrase	H335: May cause respiratory irritation	Acros Organics
H phrase	H335: May cause respiratory irritation; H315: Causes skin irritation; H319: Causes serious eye irritation	Acros Organics
Hazard	O: Oxidizing	Acros Organics
Hazard	O: Oxidizing; XI: Irritant	Acros Organics
P phrase	P210: Keep away from heat/sparks/open flames/hot surfaces. - No smoking	Acros Organics
P phrase	P210: Keep away from heat/sparks/open flames/hot surfaces. - No smoking; P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/fac	Acros Organics
P phrase	P261: Avoid breathing dust/fume/gas/mist/vapors/spray	Acros Organics
P phrase	P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water	Acros Organics
P phrase	P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting	Acros Organics
P phrase	P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue r	Acros Organics
R phrase	R11: Highly flammable.	Acros Organics
R phrase	R35: Causes severe burns.	Acros Organics
R phrase	R35: Causes severe burns.; R51/53: Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.	Acros Organics
R phrase	R36/37/38: Irritating to eyes, respiratory system and skin.	Acros Organics
R phrase	R5: Heating may cause an explosion.	Acros Organics
R phrase	R5: Heating may cause an explosion.; R8: Contact with combustible material may cause fire.; R36/37/38: Irritating to eyes, respiratory system and skin.; R44: Risk of explosion if heated under confinement.	Acros Organics
R phrase	R8: Contact with combustible material may cause fire.	Acros Organics
R phrase	R8: Contact with combustible material may cause fire.; R9: Explosive when mixed with combustible material.; R36/37/38: Irritating to eyes, respiratory system and skin.	Acros Organics
S phrase	S17: Keep away from combustible material.	Acros Organics
S phrase	S17: Keep away from combustible material.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection.	Acros Organics
S phrase	S17: Keep away from combustible material.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection.; S47: Keep at temperature not exceeding ... °C (to be	Acros Organics
S phrase	S24/25: Avoid contact with skin and eyes.	Acros Organics
S phrase	S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.	Acros Organics
S phrase	S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if you feel unwell, seek medical advice immediat	Acros Organics
S phrase	S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection.	Acros Organics
Notes	Useful electrolyte for electro-organic synthesis, e.g. thehydroxylation by anodic oxidation of aromatic ketones, acids and esters in trifluoroacetic acid.	Apollo Scientific
Hazard	XI: Irritant	Acros Organics

Activity (Go SEA)

Clustered Target Annotations
Code	Description	Organism Class	Affinity (nM)	LE (kcal/mol/atom)	Type
Z81047-2-O	Human T-cell Line (cluster #2 Of 2), Other	Other	1000	0.93	Functional ≤ 10μM

ChEMBL Target Annotations
Uniprot	Swissprot	Description	Affinity (nM)	LE (kcal/mol/atom)	Type
Z81047	Z81047	Human T-cell Line	1000	0.93	Functional ≤ 10μM

Analogs ( Draw Identity 99% 90% 80% 70% )

1242720

Synonyms (137)
Vendors (48)
Annotations (16)
Representations (1)
Notes (70)
Targets (1)
Clustered (1)
Reactome (0)
Rings (0)
Analogs (1)