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4-(2,2,2-Trifluoroethyl)aniline - 95%, high purity , CAS No.131395-17-0

COA

Grade & Purity:

≥95%

Cas Number: 131395-17-0
Molecular Weight: 175.15
PubChem CID: 14836858

In stock

Item Number

T190535

Grouped product items
SKU	Size	Availability	Price	Qty
T190535-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$45.90
T190535-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$152.90

Discover 4-(2,2,2-Trifluoroethyl)aniline by Aladdin Scientific in 95% for only $45.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	4-(2,2,2-Trifluoroethyl)aniline \| 131395-17-0 \| Benzenamine, 4-(2,2,2-trifluoroethyl)- \| MFCD04972985 \| SCHEMBL10570 \| DTXSID30564544 \| HUTUOLVNEWOEJC-UHFFFAOYSA-N \| 4-(2,2,2-trifluorethyl)aniline \| 4-(2,2,2-trifluoroethyl)-aniline \| 4-(2,2,2-trifluoro-ethyl)-aniline \| AKOS0
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

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

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Aniline and substituted anilines
Intermediate Tree Nodes	Not available
Direct Parent	Aniline and substituted anilines
Alternative Parents	Primary amines Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Aniline or substituted anilines - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
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

IUPAC Name	4-(2,2,2-trifluoroethyl)aniline
INCHI	InChI=1S/C8H8F3N/c9-8(10,11)5-6-1-3-7(12)4-2-6/h1-4H,5,12H2
InChIKey	DALKOEVEKVKJQX-UHFFFAOYSA-N
Smiles	C1=CC(=CC=C1CC(F)(F)F)N
Isomeric SMILES	C1=CC(=CC=C1CC(F)(F)F)N
PubChem CID	14836858
Molecular Weight	175.15

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	175.150 g/mol
XLogP3	2.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	175.061 Da
Monoisotopic Mass	175.061 Da
Topological Polar Surface Area	26.000 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	136.000
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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