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Merck
CN

290483

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
NACRES:
NA.22
PubChem Substance ID:
24857469
UNSPSC Code:
12352100
EC Number:
243-902-1
MDL number:
MFCD00004383
Assay:
98%

Key Documents

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Product Name

trans-3-Fluorocinnamic acid, 98%

InChI key

RTSIUKMGSDOSTI-SNAWJCMRSA-N

InChI

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

SMILES string

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

assay

98%

mp

162-164 °C (lit.)

functional group

carboxylic acid
fluoro

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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

signalword

Danger

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

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

ppe

dust mask type N95 (US), Eyeshields, Faceshields, 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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