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Key Documents

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Safety Information

290483

Sigma-Aldrich

trans-3-Fluorocinnamic acid

98%

Synonym(s):

trans-3-(3-Fluorophenyl)propenoic acid

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About This Item

Linear Formula:
FC6H4CH=CHCO2H
CAS Number:
20595-30-6
Molecular Weight:
166.15
EC Number:
243-902-1
MDL number:
MFCD00004383
UNSPSC Code:
12352100
PubChem Substance ID:
24857469
NACRES:
NA.22

Assay

98%

mp

162-164 °C (lit.)

functional group

carboxylic acid
fluoro

SMILES string

OC(=O)\C=C\c1cccc(F)c1

InChI

1S/C9H7FO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6H,(H,11,12)/b5-4+

InChI key

RTSIUKMGSDOSTI-SNAWJCMRSA-N

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General description

Aerobic degradation of 4-fluorocinnamic acid by Rhodococcus strain S2 isolated from a biofilm reactor operating for the treatment of 2-fluorophenol has been reported.

Pictograms

Skull and crossbones
GHS06

Signal Word

Danger

Hazard Statements

H301,H315,H319,H335

Hazard Classifications

Acute Tox. 3 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 2

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
08528CW

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J T Gerig et al.
Archives of biochemistry and biophysics, 232(2), 467-476 (1984-08-01)
Binding of cinnamate or fluorocinnamate anions to alpha-chymotrypsin is accompanied by chemical shift changes at each proton of the cinnamate structure. The direction and magnitude of these shifts are consistent with the expected binding of these inhibitors at the active
Catarina L Amorim et al.
Applied microbiology and biotechnology, 98(4), 1893-1905 (2013-08-21)
A bacterial strain capable of aerobic degradation of 4-fluorocinnamic acid (4-FCA) as the sole source of carbon and energy was isolated from a biofilm reactor operating for the treatment of 2-fluorophenol. The organism, designated as strain S2, was identified by

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