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:?XnXiN
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)-? .

Supplier Location

China (107)
United States (5)
United Kingdom (3)
Hong Kong (1)
Germany (1)
Hong kong (1)
India (1)

Top Suppliers

Hubei XinRunde Chemical Co., Ltd: Country:China; Business Type:Manufacturer; Telephone:86-188-74586545

Hangzhou Dayangchem Co., Ltd.: Country:China; Business Type:Manufacturer; Telephone:86-571-88938639

Wuhan Fortuna Chemical Co., Ltd.: Country:China; Business Type:Manufacturer; Telephone:0086-27-59207850

Nanjing Chemlin Chemical Co., Ltd.: Country:China; Business Type:Manufacturer; Telephone:86-25-83697070

Jinlan Pharm-Drugs Technology Co., Limited: Country:China; Business Type:Manufacturer; Telephone:86-571-85829152

AOPHARM: Country:China; Business Type:Manufacturer; Telephone:86-311-66600578

Hangzhou J&H Chemical Co., Ltd: Country:China; Business Type:Manufacturer; Telephone:86-571-87396430

Shanghai Forever Synthesis Co.,Ltd.: Country:China; Business Type:Distributor/Wholesaler; Telephone:86-21-61124658

Hui Chem Company Limited: Country:China; Business Type:Manufacturer; Telephone:86-21-60542966

Finetech Industry limited.: Country:China; Business Type:Manufacturer; Telephone:86-27-87465837

Raw materials

Bromobenzene

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