3-(2-Fluorophenyl)acrylic acid

Names

[ CAS No. ]:
451-69-4

[ Name ]:
3-(2-Fluorophenyl)acrylic acid

[Synonym ]:
3-(2-fluorophenyl)-2-propenoic acid
2-Propenoic acid, 3-(2-fluorophenyl)-, (2E)-
3-(2-Fluorophenyl)acrylic acid
(2E)-3-(2-Fluorophenyl)acrylic acid
2-fluoro-cinnamic acid
(2E)-3-(2-fluorophenyl)prop-2-enoic acid
3-(2-fluoro-phenyl)acrylic acid
TRANS-2-FLUOROCINNAMIC ACID
2-Fluor-zimtsaeure
MFCD00004370
EINECS 207-195-3
2-Fluorocinnamic acid
RARECHEM BK HC T305
o-fluoro-cinnamicaci
2-Fluorociamic acid
Cinnamic acid,o-fluoro
2-fluorincinnamic acid
O-FLUOROCINNAMIC ACID

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
281.6±15.0 °C at 760 mmHg

[ Melting Point ]:
178-180 °C(lit.)

[ Molecular Formula ]:
C₉H₇FO₂

[ Molecular Weight ]:
166.149

[ Flash Point ]:
124.1±20.4 °C

[ Exact Mass ]:
166.043015

[ PSA ]:
37.30000

[ LogP ]:
2.47

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.591

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: GD9081000

CHEMICAL NAME :: Cinnamic acid, o-fluoro-

CAS REGISTRY NUMBER :: 451-69-4

BEILSTEIN REFERENCE NO. :: 1863963

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C9-H7-F-O2

MOLECULAR WEIGHT :: 166.16

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD - Lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >500 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 5,285,1953

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter

[ Hazard Codes ]:
Xi:Irritant

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S37/39-S26

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
GD9081000

[ HS Code ]:
2916399090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Customs

[ 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%

Articles

(S,E)-N-[1-(3-heteroarylphenyl)ethyl]-3-(2-fluorophenyl)acrylamides: synthesis and KCNQ2 potassium channel opener activity.

Bioorg. Med. Chem. Lett. 15(2) , 363-6, (2005)

Replacement of the morpholinyl moiety in (S,E)-N-[1-(3-morpholinophenyl)ethyl]-3-phenylacrylamide (1) with heteroaryl groups led to the identification of (S,E)-N-1-[3-(6-fluoropyridin-3-yl)phenyl]ethy...