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3-(3-(Trifluoromethyl)phenyl)propanal - 98%, high purity , CAS No.21172-41-8

COA

Grade & Purity:

≥98%

Cas Number: 21172-41-8
Molecular Weight: 202.17
PubChem CID: 11298612
PubChem SID: 488197377

In stock

Item Number

T192028

Grouped product items
SKU	Size	Availability	Price
T192028-100mg	100mg	2	$14.90
T192028-250mg	250mg	3	$22.90
T192028-1g	1g	5	$52.90
T192028-5g	5g	5	$163.90
T192028-10g	10g	3	$284.90
T192028-25g	25g	2	$640.90

Basic Description

Synonyms	3-(3-TRIFLUOROMETHYLPHENYL)PROPIONALDEHYDE \| 3-(3-TRIFLUOROMETHYL-PHENYL)-PROPIONALDEHYDE \| 3-[3-(trifluoromethyl)phenyl]propionaldehyde \| 3-[3-(trifluoromethyl)phenyl]-propionaldehyde \| AS-18203 \| AC-29727 \| SY107576 \| AB42281 \| J-511026 \| 3-(3-Trifluoro
Specifications & Purity	≥98%
Storage Temp	Store at -20°C,Argon charged
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Trifluoromethylbenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Trifluoromethylbenzenes
Intermediate Tree Nodes	Not available
Direct Parent	Trifluoromethylbenzenes
Alternative Parents	Alpha-hydrogen aldehydes Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Trifluoromethylbenzene - Alpha-hydrogen aldehyde - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Aldehyde - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488197377
IUPAC Name	3-[3-(trifluoromethyl)phenyl]propanal
INCHI	InChI=1S/C10H9F3O/c11-10(12,13)9-5-1-3-8(7-9)4-2-6-14/h1,3,5-7H,2,4H2
InChIKey	APCCHYPQHODSBD-UHFFFAOYSA-N
Smiles	C1=CC(=CC(=C1)C(F)(F)F)CCC=O
Isomeric SMILES	C1=CC(=CC(=C1)C(F)(F)F)CCC=O
PubChem CID	11298612
Molecular Weight	202.17

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

10 results found

Lot Number	Certificate Type	Date	Item
A1911062	Certificate of Analysis	Sep 14, 2024	T192028
A1911061	Certificate of Analysis	Sep 14, 2024	T192028
F2310589	Certificate of Analysis	Apr 06, 2023	T192028
F2310592	Certificate of Analysis	Apr 06, 2023	T192028
F2310590	Certificate of Analysis	Apr 06, 2023	T192028
F2310588	Certificate of Analysis	Apr 06, 2023	T192028
F2310594	Certificate of Analysis	Apr 06, 2023	T192028
F2310595	Certificate of Analysis	Apr 06, 2023	T192028
F2310593	Certificate of Analysis	Apr 06, 2023	T192028
F2310591	Certificate of Analysis	Apr 06, 2023	T192028

Chemical and Physical Properties

Solubility	Chloroform (Sparingly); Dichloromethane (Slightly); Ethyl Acetate (Slightly)
Molecular Weight	202.170 g/mol
XLogP3	2.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	202.061 Da
Monoisotopic Mass	202.061 Da
Topological Polar Surface Area	17.100 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	188.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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