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4-(trifluoromethyl)cyclohexanamine;hydrochloride - 97%, high purity , CAS No.1087351-49-2

COA

Grade & Purity:

≥97%

Cas Number: 1087351-49-2
Molecular Weight: 203.63
EC Number: 843-582-9,855-344-1
MDL number: MFCD29058608 MFCD09040573
PubChem CID: 18769922

In stock

Item Number

C626809

Grouped product items
SKU	Size	Availability	Price
C626809-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$59.90
C626809-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$179.90
C626809-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$299.90
C626809-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$599.90

Basic Description

Synonyms	2089630-84-0 \| A3716 \| 1218943-32-8 \| PS-17401 \| SB73731 \| SCHEMBL1671814 \| 4-(trifluoromethyl)cyclohexan-1-amine hydrochloride \| 4-Trifluoromethylcyclohexylamine hydrochloride \| FT-0774688 \| MFCD26954732 \| SCHEMBL1671816 \| EN300-718015 \| SB33831 \| Z44378
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic nitrogen compounds
  - Class Organonitrogen compounds
    - Subclass Cyclohexylamines

Kingdom	Organic compounds
Superclass	Organic nitrogen compounds
Class	Organonitrogen compounds
Subclass	Cyclohexylamines
Intermediate Tree Nodes	Not available
Direct Parent	Cyclohexylamines
Alternative Parents	Organopnictogen compounds Organofluorides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Cyclohexylamine - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Primary amine - Organofluoride - Organohalogen compound - Primary aliphatic amine - Amine - Alkyl halide - Alkyl fluoride - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as cyclohexylamines. These are organic compounds containing a cyclohexylamine moiety, which consist of a cyclohexane ring attached to an amine group.
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-(trifluoromethyl)cyclohexan-1-amine;hydrochloride
INCHI	InChI=1S/C7H12F3N.ClH/c8-7(9,10)5-1-3-6(11)4-2-5;/h5-6H,1-4,11H2;1H
InChIKey	XGJNSCILISPYRX-UHFFFAOYSA-N
Smiles	C1CC(CCC1C(F)(F)F)N.Cl
Isomeric SMILES	C1CC(CCC1C(F)(F)F)N.Cl
Alternate CAS	1218943-32-8,2089630-84-0
PubChem CID	18769922
Molecular Weight	203.63

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	203.630 g/mol
XLogP3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	203.069 Da
Monoisotopic Mass	203.069 Da
Topological Polar Surface Area	26.000 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	124.000
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	2

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