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4-Hydroxy-1-(2-nitro-5-trifluoromethylphenyl)piperidine - 98%, high purity , CAS No.1072944-51-4

COA

Grade & Purity:

≥98%

Cas Number: 1072944-51-4
Molecular Weight: 290.2
PubChem CID: 46739135

In stock

Item Number

H179149

Grouped product items
SKU	Size	Availability	Price	Qty
H179149-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,463.90

Discover 4-Hydroxy-1-(2-nitro-5-trifluoromethylphenyl)piperidine by Aladdin Scientific in 98% for only $1,463.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	1072944-51-4 \| 1-(2-Nitro-5-(trifluoromethyl)phenyl)piperidin-4-ol \| 4-HYDROXY-1-(2-NITRO-5-TRIFLUOROMETHYLPHENYL)PIPERIDINE \| 1-[2-nitro-5-(trifluoromethyl)phenyl]piperidin-4-ol \| DTXSID60674766 \| MFCD11504892 \| AKOS015856529 \| SB43255 \| BS-26127 \| CS-0207849 \| 4-Hydroxy-1-
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Piperidines
    - Subclass Phenylpiperidines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Piperidines
Subclass	Phenylpiperidines
Intermediate Tree Nodes	Not available
Direct Parent	Phenylpiperidines
Alternative Parents	Trifluoromethylbenzenes Nitrobenzenes Nitroaromatic compounds Dialkylarylamines Aniline and substituted anilines Secondary alcohols Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organofluorides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Phenylpiperidine - Trifluoromethylbenzene - Nitrobenzene - Dialkylarylamine - Aniline or substituted anilines - Nitroaromatic compound - Monocyclic benzene moiety - Benzenoid - Organic nitro compound - Secondary alcohol - Tertiary amine - C-nitro compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Alcohol - Organic zwitterion - Organic salt - Organooxygen compound - Organonitrogen compound - Organofluoride - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylpiperidines. These are compounds containing a phenylpiperidine skeleton, which consists of a piperidine bound to a phenyl 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	1-[2-nitro-5-(trifluoromethyl)phenyl]piperidin-4-ol
INCHI	InChI=1S/C12H13F3N2O3/c13-12(14,15)8-1-2-10(17(19)20)11(7-8)16-5-3-9(18)4-6-16/h1-2,7,9,18H,3-6H2
InChIKey	ILFAFEMBDFFPRR-UHFFFAOYSA-N
Smiles	C1CN(CCC1O)C2=C(C=CC(=C2)C(F)(F)F)[N+](=O)[O-]
Isomeric SMILES	C1CN(CCC1O)C2=C(C=CC(=C2)C(F)(F)F)[N+](=O)[O-]
PubChem CID	46739135
Molecular Weight	290.2

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	290.240 g/mol
XLogP3	2.600
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	1
Exact Mass	290.088 Da
Monoisotopic Mass	290.088 Da
Topological Polar Surface Area	69.300 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	351.000
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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