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cis-3-[4-(trifluoromethyl)phenyl]cyclobutanamine - 97%, high purity , CAS No.1812174-93-8

COA

Grade & Purity:

≥97%

Cas Number: 1812174-93-8
Molecular Weight: 215.21
PubChem CID: 50988668

In stock

Item Number

C630655

Grouped product items
SKU	Size	Availability	Price
C630655-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$237.90
C630655-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$379.90
C630655-500mg	500mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$633.90
C630655-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,141.90

Basic Description

Synonyms	1812174-93-8 \| cis-3-[4-(trifluoromethyl)phenyl]cyclobutanamine \| cis-3-(4-(Trifluoromethyl)phenyl)cyclobutanamine \| 3-[4-(trifluoromethyl)phenyl]cyclobutan-1-amine \| 1808069-04-6 \| trans-3-(4-(Trifluoromethyl)phenyl)cyclobutanamine \| TRANS-3-(4-TRIFLUORO
Specifications & Purity	≥97%
Shipped In	Normal

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	Aralkylamines Organofluorides Monoalkylamines Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Trifluoromethylbenzene - Aralkylamine - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Primary aliphatic amine - Amine - Alkyl halide - Alkyl fluoride - 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

IUPAC Name	3-[4-(trifluoromethyl)phenyl]cyclobutan-1-amine
INCHI	InChI=1S/C11H12F3N/c12-11(13,14)9-3-1-7(2-4-9)8-5-10(15)6-8/h1-4,8,10H,5-6,15H2
InChIKey	ZUSHQSYFWIQVNY-UHFFFAOYSA-N
Smiles	C1C(CC1N)C2=CC=C(C=C2)C(F)(F)F
Isomeric SMILES	C1C(CC1N)C2=CC=C(C=C2)C(F)(F)F
PubChem CID	50988668
Molecular Weight	215.21

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	215.210 g/mol
XLogP3	2.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	215.092 Da
Monoisotopic Mass	215.092 Da
Topological Polar Surface Area	26.000 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	212.000
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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