3,5-Bis(trifluoromethyl)benzoic acid

Modify Date: 2025-08-20 19:41:41

3,5-Bis(trifluoromethyl)benzoic acid structure	Common Name	3,5-Bis(trifluoromethyl)benzoic acid
	CAS Number	725-89-3	Molecular Weight	258.117
	Density	1.5±0.1 g/cm3	Boiling Point	223.9±40.0 °C at 760 mmHg
	Molecular Formula	C₉H₄F₆O₂	Melting Point	142-143 °C(lit.)
	MSDS	Chinese USA	Flash Point	89.2±27.3 °C
	Symbol	GHS07	Signal Word	Warning

Name	3,5-Bis(trifluoromethyl)benzoic acid
Synonym	More Synonyms

Density	1.5±0.1 g/cm3
Boiling Point	223.9±40.0 °C at 760 mmHg
Melting Point	142-143 °C(lit.)
Molecular Formula	C₉H₄F₆O₂
Molecular Weight	258.117
Flash Point	89.2±27.3 °C
Exact Mass	258.011536
PSA	37.30000
LogP	4.28
Vapour Pressure	0.1±0.5 mmHg at 25°C
Index of Refraction	1.424

3,5-Bis(trifluoromethyl)benzoic acid MSDS(Chinese)

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DG4448020

CHEMICAL NAME :: Benzoic acid, 3,5-bis(trifluoromethyl)-

CAS REGISTRY NUMBER :: 725-89-3

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C9-H4-F6-O2

MOLECULAR WEIGHT :: 258.13

WISWESSER LINE NOTATION :: FXFFR CVQ EXFFF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 100 mg/kg

TOXIC EFFECTS :: Behavioral - rigidity (including catalepsy) Behavioral - muscle contraction or spasticity

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,1020,1968

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H315-H319-H335
Precautionary Statements	P261-P305 + P351 + P338
Personal Protective Equipment	dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes	Xi:Irritant
Risk Phrases	R36/37/38
Safety Phrases	S26-S36-S37/39
RIDADR	NONH for all modes of transport
WGK Germany	3
RTECS	DG4448020
HS Code	2916399090

Carbon dioxide

CAS#:124-38-9

3,5-Bis(trifluo...

CAS#:328-70-1

~94%

3,5-Bis(trifluo...

CAS#:725-89-3

Literature: Leazer Jr., Johnnie L.; Cvetovich, Raymond; Tsay, Fuh-Rong; Dolling, Ulf; Vickery, Thomas; Bachert, Donald Journal of Organic Chemistry, 2003 , vol. 68, # 9 p. 3695 - 3698

3,5-bis-trifluo...

CAS#:401-96-7

~84%

3,5-Bis(trifluo...

CAS#:725-89-3

Literature: MITSUBISHI GAS CHEMICAL COMPANY, INC. Patent: EP1500641 A1, 2005 ; Location in patent: Page 9 ;

Carbon dioxide

CAS#:124-38-9

1,3-Bis(trifluo...

CAS#:402-31-3

~13%

2,4-Bis(trifluo...

CAS#:32890-87-2

3,5-Bis(trifluo...

CAS#:725-89-3

Literature: Chemistry - A European Journal, , vol. 4, # 7 p. 1281 - 1286

1,3,5-Tris(trif...

CAS#:729-81-7

~82%

3,5-Bis(trifluo...

CAS#:725-89-3

Literature: Kethe, Anila; Tracy, Adam F.; Klumpp, Douglas A. Organic and Biomolecular Chemistry, 2011 , vol. 9, # 12 p. 4545 - 4549

1,3-Bis(trifluo...

CAS#:402-31-3

3,5-Bis(trifluo...

CAS#:725-89-3

Literature: Journal of Organic Chemistry, , vol. 68, # 9 p. 3695 - 3698

Carbon dioxide

CAS#:124-38-9

1,3-Bis(trifluo...

CAS#:402-31-3

2,6-Bis(trifluo...

CAS#:24821-22-5

2,4-Bis(trifluo...

CAS#:32890-87-2

Detail

Literature: Tetrahedron, , vol. 55, # 4 p. 909 - 918

Precursor 5
CAS#:124-38-9 Carbon dioxide CAS#:328-70-1 3,5-Bis(trifluo... CAS#:401-96-7 3,5-bis-trifluo... CAS#:402-31-3 1,3-Bis(trifluo...
CAS#:729-81-7 1,3,5-Tris(trif...
DownStream 9
CAS#:32707-89-4 (3,5-Bis(triflu... CAS#:174083-39-7 3,5-BIS(TRIFLUO... CAS#:402-31-3 1,3-Bis(trifluo... CAS#:401-95-6 3,5-Bis(trifluo...
CAS#:30071-93-3 1-(3,5-Bis(trif... CAS#:85068-33-3 [3,5-Bis(triflu... CAS#:785-56-8 3,5-Bis(trifluo... CAS#:131805-94-2 1-(3,5-Bis(trif...
CAS#:26107-82-4 3,5-bis(trifluo...

HS Code	2916399090
Summary	2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

3-Benzyloxy-2-phenylpiperidine NK₁ antagonists: the influence of alpha methyl substitution. Swain CJ, et al.

Bioorg. Med. Chem. Lett. 7(23) , 2959-62, (1997)

einecs 211-970-1

3,5-Di(trifluoromethyl)benzoic acid

Benzoic acid, 3,5-bis(trifluoromethyl)-

3,5-Bis(trifluoromethyl)benzoic acid

MFCD00000388

FXFFR CVQ EXFFF

mbt-boa

3,5-bis(trifluoromethyl)benzoicacid

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China
Product Name: 3,5-Bis(trifluoromethyl)benzoic acid
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3,5-Bis(trifluoromethyl)benzoic acid

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