EUROAPI, the leading small molecules API player, provides both API sales & CDMO services.

ACCESS ALL DATA
Browse all information
CHEMISTRY
Discover Molecule Insights

DEVELOPMENTS

3 Drugs in Development

3 Drugs in Development

Synopsis

ACTIVE PHARMA INGREDIENTS

API Suppliers

USDMF

CEP/COS

JDMF

EU WC

KDMF

NDC API

VMF

Listed Suppliers

API REF. PRICE (USD/KG)

$ 0

MARKET PLACE

API

FDF

0INTERMEDIATES

FINISHED DOSAGE FORMULATIONS

FDF Dossiers

FDA Orange Book

Europe

Canada

Australia

South Africa

Listed Dossiers

3DRUGS IN DEVELOPMENT

DRUG PRODUCT COMPOSITIONS

REF. STANDARDS OR IMPURITIES

EDQM

USP

Others

PATENTS & EXCLUSIVITIES

US Patents

US Exclusivities

Health Canada Patents

DIGITAL CONTENT

Data Compilation #PharmaFlow

Stock Recap #PipelineProspector

Weekly News Recap #Phispers

News #PharmaBuzz

GLOBAL SALES INFORMATION

US Medicaid (USD)

Annual Reports (USD Million)

Finished Drug Prices

0RELATED EXCIPIENT COMPANIES

0EXCIPIENTS BY APPLICATIONS

Chemistry

Click the arrow to open the dropdown

Click the button for full data set

Also known as: Schembl19822405

Molecular Formula

C₁₂H₁₄F₂O₂

Molecular Weight

228.23 g/mol

InChI Key

JHINHHFRYYKQPM-UHFFFAOYSA-N

1 2D Structure

Difluorocyclohexyloxyphenol

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-(2,2-difluorocyclohexyl)oxyphenol

2.1.2 InChI

InChI=1S/C12H14F2O2/c13-12(14)8-2-1-3-11(12)16-10-6-4-9(15)5-7-10/h4-7,11,15H,1-3,8H2

2.1.3 InChI Key

JHINHHFRYYKQPM-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CCC(C(C1)OC2=CC=C(C=C2)O)(F)F

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Schembl19822405

2.3 Create Date

2018-06-23

3 Chemical and Physical Properties

Molecular Formula	C₁₂H₁₄F₂O₂
Molecular Weight	228.23 g/mol
XLogP3	3.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	228.09618601 g/mol
Monoisotopic Mass	228.09618601 g/mol
Topological Polar Surface Area	29.5 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	225
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1