Skip to Content
Merck
CN
All Photos(1)

Key Documents

View All Documentation

Safety Information

178926

Sigma-Aldrich

3-(Trifluoromethyl)cinnamic acid, predominantly trans

98%

Sign Into View Organizational & Contract Pricing
All Photos(1)

About This Item

Linear Formula:
CF3C6H4CH=CHCO2H
CAS Number:
779-89-5
Molecular Weight:
216.16
EC Number:
212-301-6
MDL number:
MFCD00004393
UNSPSC Code:
12352100
PubChem Substance ID:
24850780
NACRES:
NA.22

Assay

98%

mp

135-137 °C (lit.)

functional group

carboxylic acid
fluoro

SMILES string

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

InChI

1S/C10H7F3O2/c11-10(12,13)8-3-1-2-7(6-8)4-5-9(14)15/h1-6H,(H,14,15)/b5-4+

InChI key

KSBWHDDGWSYETA-SNAWJCMRSA-N

Application

3-(Trifluoromethyl)cinnamic acid was used in the synthesis of cinacalcet.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

新产品

Choose from one of the most recent versions:

Certificates of Analysis (COA)

Lot/Batch Number
MKCG5444
MKCG5442
MKBW8877V
MKBH8821V
MKBF7855V

Don't see the Right Version?

If you require a particular version, you can look up a specific certificate by the Lot or Batch number.

Search for a COA

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Practical synthesis of the calcimimetic agent, cinacalcet.
Thiel OR, et al.
Tetrahedron Letters, 49(1), 13-15 (2008)

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service