1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine

CAS

921605-76-7

Catalog Number

ACM921605767

Category

Other Products

Molecular Weight

345.356690 [g/mol]

Molecular Formula

C17H22F3NO3

MSDS COA Spec Sheet

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Specification

Synonyms

1-Boc-4-(2-(Trifluoromethyl)phenoxy)piperidine;tert-Butyl 4-(2-(trifluoromethyl)phenoxy)piperidine-1-carboxylate

IUPAC Name

tert-butyl 4-[2-(trifluoromethyl)phenoxy]piperidine-1-carboxylate

Canonical SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC=CC=C2C(F)(F)F

InChI Key

NMYLUTZGNZLFET-UHFFFAOYSA-N

Boiling Point

394.295ºC at 760 mmHg

Flash Point

192.263ºC

Density

1.2 g/cm³

Exact Mass

345.15500

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine?

The molecular formula of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine is C17H22F3NO3.

What are the synonyms for 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine?

The synonyms for 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine are tert-butyl 4-(2-(trifluoromethyl)phenoxy)piperidine-1-carboxylate, tert-butyl 4-[2-(trifluoromethyl)phenoxy]piperidine-1-carboxylate, and 4-(2-trifluoromethyl-phenoxy)-piperidine-1-carboxylic acid tert-butyl ester.

What is the molecular weight of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine?

The molecular weight of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine is 345.36 g/mol.

What is the IUPAC name of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine?

The IUPAC name of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine is tert-butyl 4-[2-(trifluoromethyl)phenoxy]piperidine-1-carboxylate.

What is the InChI code of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine?

The InChI code of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine is InChI=1S/C17H22F3NO3/c1-16(2,3)24-15(22)21-10-8-12(9-11-21)23-14-7-5-4-6-13(14)17(18,19)20/h4-7,12H,8-11H2,1-3H3.

What is the InChIKey of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine?

The InChIKey of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine is NMYLUTZGNZLFET-UHFFFAOYSA-N.

What is the Canonical SMILES of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine?

The Canonical SMILES of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine is CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC=CC=C2C(F)(F)F.

What is the XLogP3-AA value of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine?

The XLogP3-AA value of 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine is 4.2.

How many hydrogen bond donor count does 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine have?

1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine has 0 hydrogen bond donor count.

How many rotatable bond count does 1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine have?

1-Boc-4-(2-(trifluoromethyl)phenoxy)piperidine has 4 rotatable bond count.