Related Searches: 1-Bromo-4-(trifluoromethoxy)benzene, Benzene,1-bromo-2,3-difluoro-, Benzene,1-bromo-2,3,4-trifluoro-, 1-bromo-4-nitrobenzene, 1-Bromo-4-chlorobutane, View all

1-Bromo-4-(trifluoromethoxy)benzene(CAS No. 407-14-7)

1-Bromo-4-(trifluoromethoxy)benzene C7H4BrF3O (cas 407-14-7) Molecular Structure

407-14-7 Structure

Identification and Related Records

【Name】
1-Bromo-4-(trifluoromethoxy)benzene
【Iupac name】
1-bromo-4-(trifluoromethoxy)benzene
【CAS Registry number】
407-14-7
【Synonyms】
P-bromotrifluoromethoxybenzene
4-bromotrifluoromethoxybenzene
p-Bromo (Trifluoromethoxy)Benzene
4-(Trifluoromethoxy)-bromobenzene
1-Bromo-4(trifluoromethoxy) benzene
4-(Trifluoromethoxy)bromobenzene
【EINECS(EC#)】
206-979-2
【Molecular Formula】
C7H4BrF3O (Products with the same molecular formula)
【Molecular Weight】
241.01
【Inchi】
InChI=1/C7H4BrF3O/c8-5-1-3-6(4-2-5)12-7(9,10)11/h1-4H
【InChIKey】
SEAOBYFQWJFORM-UHFFFAOYSA-N
【Canonical SMILES】
C1=CC(=CC=C1OC(F)(F)F)Br
【MOL File】
407-14-7.mol

Chemical and Physical Properties

【Appearance】
clear colourless to yellow liquid
【Density】
1.622
【Boiling Point】
153-155℃
【Vapour】
6mmHg at 25°C
【Refractive Index】
1.46-1.462
【Flash Point】
67℃
【Solubilities】
11.7 mg/L (20 C)
【Stability】
No data.
【HS Code】
29093090
【Storage temp】
Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
【Computed Properties】
Molecular Weight:241.00527 [g/mol]
Molecular Formula:C7H4BrF3O
XLogP3-AA:3.8
H-Bond Donor:0
H-Bond Acceptor:4
Rotatable Bond Count:1
Exact Mass:239.939762
MonoIsotopic Mass:239.939762
Topological Polar Surface Area:9.2
Heavy Atom Count:12
Formal Charge:0
Complexity:140
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Hydrophobe Count:1
Feature 3D Ring Count:1
Effective Rotor Count:2
Conformer Sampling RMSD:0.6
CID Conformer Count:2

Safety and Handling

【Hazard Codes】
Xi:Irritant
【Risk Statements】
R36/37/38
【Safety Statements 】
S26;S37/39
【HazardClass】
IRRITANT
【Hazard Note】

Irritant

【Safety】

Hazard Codes:?HarmfulXnIrritantXiDangerousN
Risk Statements: 22-36/37/38-43-51/53?
R22: Harmful if swallowed
R36/37/38: Irritating to eyes, respiratory system and skin
R43: May cause sensitization by skin contact
R51/53: Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment
Safety Statements: 26-36/37-61-37/39-36?
S26: In case of contact with eyes, rinse immediately with plenty of WATER and seek medical advice?
S36/37: Wear suitable protective clothing and gloves
S61: Avoid release to the environment. Refer to special instructions / safety data sheets
S37/39: Wear suitable gloves and eye/face protection
S36:Wear suitable protective clothing
RIDADR: UN 3082 9/PG 3
WGK Germany: 1
Hazard Note: Irritant
HazardClass: IRRITANT

【Transport】
UN 3082 9
【Specification】

?1-Bromo-4-(trifluoromethoxy)benzene (CAS NO.407-14-7) is also called as 4-Bromo-alpha,alpha,alpha-trifluoroanisole ; 4-Bromo(trifluoromethoxy)benzene ; 4-(Trifluoromethoxy)bromobenzene ; P-trifluoromethoxy bromobenzene ; P-bromotrifluoromethoxybenzene ; Benzene, 1-bromo-4-(trifluoromethoxy)-? .

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Telephone:86-27-87465837
Raw materials

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