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Tert-butyl [(2R,3S)-2-(2,5-difluorophenyl)-5-hydroxytetrahydro-2H-pyran-3-yl]carbamate is a complex synthetic chemical compound that belongs to the class of tetrahydropyrans, which are oxygen-containing heterocyclic compounds. It features a hydroxy group (-OH), a carbamate group (an organic compound derived from carbamic acid), and a phenyl group with two fluorine replacements, indicating potential fluorinated aromatic properties. Its molecular structure suggests chirality, meaning it has a non-superimposable mirror image due to asymmetric carbon atoms (stereocenters), which can influence the compound's bioactive properties. The exact properties and uses of this chemical compound would typically be determined through laboratory testing and research.

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  • (2xi,5R)-1,5-Anhydro-3,4-dideoxy-5-C-(2,5-difluorophenyl)-4-[[(1,1-dimethylethoxy)carbonyl]amino]-D-glycero-pentitol

    Cas No: 1172623-99-2

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  • 1172623-99-2 Structure
  • Basic information

    1. Product Name: tert-butyl [(2R,3S)-2-(2,5-difluorophenyl)-5-hydroxytetrahydro-2H-pyran-3-yl]carbaMate
    2. Synonyms: tert-butyl [(2R,3S)-2-(2,5-difluorophenyl)-5-hydroxytetrahydro-2H-pyran-3-yl]carbaMate;Omarigliptin Intermediate;D-glycero-Pentitol, 1,5-anhydro-3,4-dideoxy-5-C-(2,5-difluorophenyl)-4-[[(1,1-dimethylethoxy)carbonyl]amino]-, (2ξ,5R)-;(2xi,5R)-1,5-Anhydro-3,4-dideoxy-5-C-(2,5-difluorophenyl)-4-[[(1,1-dimethylethoxy)carbonyl]amino]-D-glycero-pentitol;Omarigliptin Impurity 2
    3. CAS NO:1172623-99-2
    4. Molecular Formula: C16H21F2NO4
    5. Molecular Weight: 329.3390464
    6. EINECS: N/A
    7. Product Categories: intermediate
    8. Mol File: 1172623-99-2.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 439.7±45.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.26±0.1 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: Sealed in dry,Store in freezer, under -20°C
    8. Solubility: N/A
    9. PKA: 11.31±0.60(Predicted)
    10. CAS DataBase Reference: tert-butyl [(2R,3S)-2-(2,5-difluorophenyl)-5-hydroxytetrahydro-2H-pyran-3-yl]carbaMate(CAS DataBase Reference)
    11. NIST Chemistry Reference: tert-butyl [(2R,3S)-2-(2,5-difluorophenyl)-5-hydroxytetrahydro-2H-pyran-3-yl]carbaMate(1172623-99-2)
    12. EPA Substance Registry System: tert-butyl [(2R,3S)-2-(2,5-difluorophenyl)-5-hydroxytetrahydro-2H-pyran-3-yl]carbaMate(1172623-99-2)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 1172623-99-2(Hazardous Substances Data)

1172623-99-2 Usage

Uses

Used in Pharmaceutical Industry:
Tert-butyl [(2R,3S)-2-(2,5-difluorophenyl)-5-hydroxytetrahydro-2H-pyran-3-yl]carbamate is used as a potential pharmaceutical compound for its potential bioactive properties. The presence of a carbamate group and fluorinated phenyl group may contribute to its interaction with biological targets, making it a candidate for drug development.
Used in Chemical Research:
tert-butyl [(2R,3S)-2-(2,5-difluorophenyl)-5-hydroxytetrahydro-2H-pyran-3-yl]carbaMate is used as a research tool in the field of organic chemistry, particularly for studying the effects of chirality and fluorination on molecular properties and reactivity. Its unique structure allows chemists to explore new synthetic pathways and investigate its potential applications in various chemical processes.
Used in Material Science:
Tert-butyl [(2R,3S)-2-(2,5-difluorophenyl)-5-hydroxytetrahydro-2H-pyran-3-yl]carbamate may be used in the development of new materials with specific properties, such as improved stability or reactivity, due to its fluorinated aromatic characteristics and chiral nature. This could be particularly relevant in the fields of polymer science and advanced materials.

Check Digit Verification of cas no

The CAS Registry Mumber 1172623-99-2 includes 10 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 7 digits, 1,1,7,2,6,2 and 3 respectively; the second part has 2 digits, 9 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 1172623-99:
(9*1)+(8*1)+(7*7)+(6*2)+(5*6)+(4*2)+(3*3)+(2*9)+(1*9)=152
152 % 10 = 2
So 1172623-99-2 is a valid CAS Registry Number.

1172623-99-2SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name tert-butyl [(2R,3S)-2-(2,5-difluorophenyl)-5-hydroxytetrahydro-2H-pyran-3-yl]carbamate

1.2 Other means of identification

Product number -
Other names (2xi,5R)-1,5-Anhydro-3,4-dideoxy-5-C-(2,5-difluorophenyl)-4-[[(1,1-dimethylethoxy)carbonyl]amino]-D-glycero-pentitol

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:1172623-99-2 SDS

1172623-99-2Relevant articles and documents

Ternary fused ring substituted six-membered ring derivatives and their use in medicine

-

, (2019/01/22)

The invention relates to a fused tricyclic substituted amino six-membered ring derivative and application thereof in medicine, particularly a fused tricyclic substituted amino six-membered ring derivative shown in a formula (I) or stereoisomers and pharmaceutically acceptable salts or pro-drugs of the derivative, a pharmaceutical composition comprising the derivative and use of the derivative in preparing a dipeptidyl peptidase IV (DPP-IV) inhibitor in medicine, wherein the substituents in the formula (I) are defined as in the description. The formula (I) is shown in the description.

Synthesis method of chiral amino pyrone compounds

-

, (2017/04/25)

The invention relates to a synthesis method of chiral amino pyrone compounds, and a pure chiral structure of an intermediate of the reaction namely N-Boc-1-(2,5-difluorophenyl)-1-oxo-2-S-aminopentyl-4-yne. The synthesis reaction formula is represented in the description.

AMINO PYRANOID RING DERIVATIVE AND COMPOSITION AND USE THEREOF

-

, (2017/05/02)

The present invention relates to an amino pyran ring derivative and a composition and use thereof, and in particular, to an amino pyran ring derivative represented by general formula (I) or a stereoisomer, a pharmaceutically acceptable salt or a prodrug thereof, a pharmaceutical composition comprising the derivative, and their medical use in the manufacture of a di-peptidyl peptidase IV (DPP-IV) inhibitor, in formula (I) the substituents are defined the same as those in the specification.

PROCESS FOR THE PREPARATION OF OMARIGLIPTIN

-

, (2017/06/23)

The present invention provides a process for preparing omarigliptin.

Amino 6-membered ring derivative and pharmaceutical applications thereof including the use for manufacturing dipeptidyl peptidase-4(IDPP-IV) inhibitor

-

, (2017/07/31)

The present invention relates to an amino 6-membered ring derivative and pharmaceutical applications thereof, which specifically relates to the amino 6-membered ring derivative represented by the general formula (I) or stereoisomers thereof, pharmaceutically acceptable salts thereof, a prodrug, a pharmaceutical composition comprising the derivative, and the pharmaceutical use for manufacturing dipeptidyl peptidase-4(IDPP-IV) inhibitor, wherein the definition of each substituent in the general formula (I) is the same as described in the specification.

Three-membered fused ring substituted amino six-membered ring derivative and medicine applications thereof relates to a three-membered fused ring substituted amino six-membered ring derivative as shown in the general formula

-

, (2017/08/02)

The present invention relates to a three-membered fused ring substituted amino six-membered ring derivative and medicine applications thereof, and more particularly to a three-membered fused ring substituted amino six-membered ring derivative as shown in the general formula (I) or a stereoisomer of the derivative, a pharmaceutically acceptable salt, a prodrug, a medicinal composition containing the derivative and an application of the derivative to preparation of the medicine, namely a dipeptidyl peptidase IV(DPP-IV) inhibitor, wherein the definitions of the various substituents in the general formula (I) are the same as those in the specification.

Pyrrole imidazole ring derivative and medical use thereof wherein the compound represented by the general formula (I) has excellent inhibitory effect on and selectivity of dipeptidyl peptidase IV(DPP-IV)

-

, (2017/08/02)

The present invention relates to a pyrrole imidazole ring derivative and medical use thereof, more particularly a pyrrole imidazole ring derivative represented by the general formula (I) or stereoisomers thereof, pharmaceutically acceptable salts thereof, prodrugs, pharmaceutical compositions containing the derivative, and pharmaceutical applications for the preparation of dipeptidyl peptidase IV(DPP-IV) inhibitors, wherein the definitions of all substitution groups in general formula (I) are the same as those defined in the specification.

Aminopyran ring derivative and its composition and application wherein the dipeptidyl peptidase IV (DPP-IV) inhibitor is used for preparing the drugs for treating metabolic diseases

-

, (2017/08/22)

The present invention relates to an aminopyran ring derivative and its composition and application, specifically speaking, relating to the aminopyran ring derivative represented by the general formula (I) or its stereoisomer, pharmaceutically acceptable salt, prodrug, pharmaceutical composition containing the derivative and the preparation of dipeptidyl peptidase IV (DPP-IV) inhibitor for medical use, wherein the definitions of the substituents in the general formula (I) are the same as those defined in the patent specification.

Amino six member ring derivatives and their use in medicine (by machine translation)

-

, (2017/09/20)

The invention relates to a six-member ring amino derivatives and its application in medicine, specifically relates to the general formula (I) as shown by the six-member ring of the amino derivative or its stereoisomer, pharmaceutically acceptable salt, prodrug, pharmaceutical composition containing the derivative of the dipeptidyl peptidase IV and the preparation (dPP CGI-iV) inhibitors of their medical use, wherein the general formula (I) definition of each substituent in the definition of the description of the same. (by machine translation)

Pyran derivative salt or its salt hydrate and its preparation and use (by machine translation)

-

, (2017/08/29)

The invention relates to a benzopyran derivative salt or its salt hydrate and its preparation and application, and in particular relates to dipeptide kinase - IV inhibitor a pharmaceutically acceptable salt or its salt hydrate, and its preparation method and application, further for the purposes of formula (I) as shown in the salt or its salt hydrate and its preparation method and application. (by machine translation)

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