ChemicalBook--->CAS DataBase List--->402-31-3

402-31-3

402-31-3 Structure

402-31-3 Structure
IdentificationMore
[Name]

1,3-Bis(trifluoromethyl)-benzene
[CAS]

402-31-3
[Synonyms]

1,3-BIS(TRIFLUOROMETHYL)BENZENE
1,3-DI(TRIFLUOROMETHYL)BENZENE
A,A,A,A',A',A'-HEXAFLUORO-M-XYLENE
ALPHA,ALPHA,ALPHA,ALPHA',ALPHA',ALPHA'-HEXAFLUORO-M-XYLENE
MTF-TFM
M-XYLENE HEXAFLUORIDE
Xylene hexafluoride
1,3-bis(trifluoromethyl)-benzen
3-bis(Trifluoromethyl)benzene
alphaalphaalpha-alpha',alpha',alpha'-Hexafluoro-m-xylol
Benzene,1,3-bis(trifluoromethyl)-
Hexafluoro-m-xylene
m-Bis(trifluoromethyl)benzene
m-Ditrifluoromethylbenzene
m-Xylene, alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-
1,3-Di(trifluoromethyl)benzeneXylene hexafluoride
alpha,alpha,alpha,beta,beta,beta-hexafluoro-m-xylene
1,3-TrifluoromethylBenzene
1,3-Bis(trifluoromethyl)benzene, 98+%
M-BIS(TRIFLUORO-METNY)BENZENE
[EINECS(EC#)]

206-939-4
[Molecular Formula]

C8H4F6
[MDL Number]

MFCD00000392
[Molecular Weight]

214.11
[MOL File]

402-31-3.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR COLOURLESS LIQUID
[Melting point ]

-35°C
[Boiling point ]

116-116.3 °C(lit.)
[density ]

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

n20/D 1.379(lit.)
[Fp ]

26 °C
[storage temp. ]

Flammables area
[form ]

clear liquid
[color ]

Colorless to Light yellow to Light orange
[Specific Gravity]

1.378
[Water Solubility ]

Insoluble in water. Soluble in alcohol, ether, benzene.
[BRN ]

2052589
[Dielectric constant]

5.9800000000000004
[InChI]

1S/C8H4F6/c9-7(10,11)5-2-1-3-6(4-5)8(12,13)14/h1-4H
[InChIKey]

SJBBXFLOLUTGCW-UHFFFAOYSA-N
[SMILES]

FC(F)(F)c1cccc(c1)C(F)(F)F
[LogP]

3.83
[CAS DataBase Reference]

402-31-3(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzene, 1,3-bis(trifluoromethyl)-(402-31-3)
[EPA Substance Registry System]

402-31-3(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)Exclamation Mark (GHS07)Environment (GHS09)
GHS02,GHS07,GHS09
[Signal word ]

Warning
[Hazard statements ]

H226-H315-H319-H335-H411
[Precautionary statements ]

P210-P233-P240-P273-P303+P361+P353-P305+P351+P338
[Hazard Codes ]

Xi,F
[Risk Statements ]

R10:Flammable.
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 .
[RIDADR ]

UN 1993 3/PG 3
[WGK Germany ]

3
[Hazard Note ]

Flammable
[TSCA ]

T
[REACH Registrations]

Inactive
[HazardClass ]

3
[PackingGroup ]

III
[HS Code ]

29039990
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

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

Hydrogen fluoride-->m-Xylene-->p-Fluorotoluene
[Preparation Products]

3,5-Bis(trifluoromethyl)benzoic acid-->Perfluoro-1,3-dimethylcyclohexane-->Perfluoro(methylcyclohexane)-->2,4-Bis(trifluoromethyl)benzoic acid-->3,5-Bis(trifluoromethyl)nitrobenzene-->3,5-Bis(trifluoromethyl)phenol-->3-Methylbenzotrifluoride-->Benzotrifluoride-->Isophthalic acid-->Benzenemethanol, 2,6-bis(trifluoromethyl)-
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1,3-Di(trifluoromethyl)benzene(402-31-3).msds
Hazard InformationBack Directory
[Chemical Properties]

CLEAR COLOURLESS LIQUID
[Uses]

1,3-Bis(trifluoromethyl)benzene undergoes regioselective metalation and subsequent carboxylation at position 2 to give 2,6-bis(trifluoromethyl)benzoic acid. a convenient, selective synthesis of bis[2,4-bis(trifluoromethyl)phenyl]phosphane derivatives with 1,3-bis(trifluoromethyl)benzene as starting material.
[General Description]

Lithiation reaction of 1,3-bis(trifluoromethyl)benzene has been investigated. 1,3-Bis(trifluoromethyl)benzene undergoes regioselective metalation and subsequent carboxylation at position 2 to give 2,6-bis(trifluoromethyl)benzoic acid.
Spectrum DetailBack Directory
[Spectrum Detail]

1,3-Bis(trifluoromethyl)-benzene(402-31-3)MS
1,3-Bis(trifluoromethyl)-benzene(402-31-3)1HNMR
1,3-Bis(trifluoromethyl)-benzene(402-31-3)13CNMR
1,3-Bis(trifluoromethyl)-benzene(402-31-3)IR1
1,3-Bis(trifluoromethyl)-benzene(402-31-3)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1,3-Bis(trifluoromethyl)benzene, 98%(402-31-3)
[Alfa Aesar]

1,3-Bis(trifluoromethyl)benzene, 98+%(402-31-3)
[Sigma Aldrich]

402-31-3(sigmaaldrich)
[TCI AMERICA]

1,3-Bis(trifluoromethyl)benzene,>98.0%(GC)(402-31-3)
402-31-3 suppliers list
Company Name: Zhengzhou AnMusi Chemical Products Co., Ltd.  Gold
Telephone: 15981811963 18737195735
Website: www.chemicalbook.com/showsupplierproductslist19767/0_en.htm
Company Name: Zhengzhou Alfachem Co., Ltd.  Gold
Telephone: 13333829863 13333829863
Website: www.alfachem.cn
Company Name: Zhengzhou Acme Chemical Co., Ltd.  Gold
Telephone: 0371-63315541 13323832564
Website: www.chemicalbook.com/contactus_30718.htm
Company Name: iFar Chemical Technology  Gold
Telephone: 0086-510-83488850
Website: http://www.ifar.com.cn
Company Name: Hubei yongkuo Technology Co., Ltd  Gold
Telephone: 027-59223108 15972152991
Website: www.hbyongkuo.com/contact.html
Company Name: Shandong Vantage Specialty Chemicals Biotechnology Co., Ltd.  Gold
Telephone: 13396369453 18678026865
Website: fantaichem.webd.testwebsite.cn
Company Name: J & K SCIENTIFIC LTD.  
Telephone: 18210857532 18210857532
Website: https://www.jkchemical.com
Company Name: Meryer (Shanghai) Chemical Technology Co., Ltd.  
Telephone: 4006356688 18621169109
Website: www.x-labseek.com/
Company Name: Liaoning Tianhua Chemical Co., Ltd.  
Telephone: 0418-6530555 2855550
Website: www.chemicalbook.com/ShowSupplierProductsList6177/0_EN.htm
Company Name: Alfa Aesar  
Telephone: 400-6106006
Website: http://chemicals.thermofisher.cn
Company Name: TCI (Shanghai) Development Co., Ltd.  
Telephone: 021-67121386
Website: https://www.tcichemicals.com/CN/zh/
Company Name: Beijing dtftchem Technology Co., Ltd.  
Telephone: 010-60275820 13031183356
Website: www.dtfchem.com
Company Name: Beijing HwrkChemical Technology Co., Ltd  
Telephone: 89508211 18501085097
Website: www.hwrkchemical.com
Company Name: BeiJing Hwrk Chemicals Limted  
Telephone: 0757-86329057 18934348241
Website: www.hwrkchemical.com/
Company Name: Energy Chemical  
Telephone: 400-0056266
Website: www.energy-chemical.com
Company Name: Wuhan Chemwish Technology Co., Ltd  
Telephone: 86-027-67849912
Website: www.chemwish.com
Company Name: Capot Chemical Co., Ltd  
Telephone: +86 (0) 571 85 58 67 18
Website: www.capotchem.com
Company Name: Beijing Ouhe Technology Co., Ltd  
Telephone: 13552068683 13522913783
Website: www.ouhetech.cn/
Tags:402-31-3 Related Product Information
401-80-9 454-89-7 88-17-5 709-63-7 108-38-3 447-61-0 433-97-6 1493-13-6 108-41-8 81-15-2 13630-19-8 1330-20-7 99-08-1 433-19-2 98-08-8 71-43-2 725-89-3 328-70-1