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(S)-2-(1-METHOXY-1-METHYLETHYL)PYRROLIDINE is a specialty chemical compound belonging to the pyrrolidine class, which is an essential group of organic compounds found in numerous natural products and bioactive substances. (S)-2-(1-METHOXY-1-METHYLETHYL)PYRROLIDINE is characterized by its specific 'left-handed' stereochemistry denoted by the "(S)" prefix, which can significantly influence its biological activity. It features a methoxy and methylethyl substituent, suggesting the presence of an oxygen atom and additional carbon chains that may affect its reactivity and polarity. Further information regarding its properties, applications, and safety should be obtained from detailed materials safety data sheets or product information.

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  • 118971-00-9 Structure
  • Basic information

    1. Product Name: (S)-2-(1-METHOXY-1-METHYLETHYL)PYRROLIDINE
    2. Synonyms: (S)-2-(1-METHOXY-1-METHYLETHYL)PYRROLIDINE;(S)-2-(2-Methoxypropan-2-yl)pyrrolidine
    3. CAS NO:118971-00-9
    4. Molecular Formula: C8H17NO
    5. Molecular Weight: 143.228
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 118971-00-9.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 173℃
    3. Flash Point: 65℃
    4. Appearance: /
    5. Density: 0.910
    6. Vapor Pressure: 1.26mmHg at 25°C
    7. Refractive Index: 1.443
    8. Storage Temp.: 2-8°C(protect from light)
    9. Solubility: N/A
    10. PKA: 10.85±0.10(Predicted)
    11. CAS DataBase Reference: (S)-2-(1-METHOXY-1-METHYLETHYL)PYRROLIDINE(CAS DataBase Reference)
    12. NIST Chemistry Reference: (S)-2-(1-METHOXY-1-METHYLETHYL)PYRROLIDINE(118971-00-9)
    13. EPA Substance Registry System: (S)-2-(1-METHOXY-1-METHYLETHYL)PYRROLIDINE(118971-00-9)
  • 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: 118971-00-9(Hazardous Substances Data)

118971-00-9 Usage

Uses

Since the provided materials do not specify the uses of (S)-2-(1-METHOXY-1-METHYLETHYL)PYRROLIDINE, it is not possible to list its applications based on the given information. However, given its classification as a pyrrolidine and its presence in pharmaceuticals and agrochemicals, it can be inferred that this compound may have potential applications in these industries. To provide accurate use cases, more explicit information or data would be required.

Check Digit Verification of cas no

The CAS Registry Mumber 118971-00-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,8,9,7 and 1 respectively; the second part has 2 digits, 0 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 118971-00:
(8*1)+(7*1)+(6*8)+(5*9)+(4*7)+(3*1)+(2*0)+(1*0)=139
139 % 10 = 9
So 118971-00-9 is a valid CAS Registry Number.
InChI:InChI=1/C8H17NO/c1-8(2,10-3)7-5-4-6-9-7/h7,9H,4-6H2,1-3H3/t7-/m0/s1

118971-00-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name (2S)-2-(2-methoxypropan-2-yl)pyrrolidine

1.2 Other means of identification

Product number -
Other names -

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:118971-00-9 SDS

118971-00-9Relevant articles and documents

Asymmetric Diels-Alder Reactions with Chiral 1-Azadienes

Beaudegnies, Renaud,Ghosez, Leon

, p. 557 - 560 (1994)

Chiral 1-azadienes 1 derived from α,β-unsaturated aldehydes and Enders' hydrazines cycloadd to cyclic dienophiles with high facial selectivities.The adducts can be readily converted into enantiomerically pure piperidine derivatives. - Keywords: asymmetric cycloadditions, 1-azadienes, piperidines.

Optically active 3-amino-2H-azirines as synthons for enantiomerically pure α,α-disubstituted α-amino acids: Synthesis of the α-methylphenylalanine synthons and some model peptides

Bucher,Linden,Heimgartner

, p. 935 - 946 (2007/10/02)

The synthesis of a novel 2-benzyl-2-methyl-3-amino-2H-azirine derivative with a chiral amino group is described. Chromatographic separation of the diastereoisomer mixture yielded the pure diastereoisomers 9a and 9b which are the D- and L-2-methylphenylalanine ((α-Me)Phe) synthons, respectively. The reaction of 9a and 9b with thiobenzoic acid and with Z-leucine yielded the monothiodiamides 10a and 10b and the dipeptide derivatives 11a and 11b, respectively. Methanolysis of 11b yielded 12b. The absolute configuration of 10a was established by X-ray crystallography. The absolute configuration of (α-Me)Phe in 12b has been deduced from the known configuration of L-leucine.

A highly enantioselective synthesis of phosphate triesters

Nakayama, Kensaku,Thompson, Wayne J.

, p. 6936 - 6942 (2007/10/02)

A general methodology for the preparation of both enantiomers of a variety of trialkyl phosphates with enantiomeric excesses ranging from 87 to 92% is described. Bis(2,4-dichlorophenyl) phosphoramidates bearing a 2-substituted pyrrolidine moiety as the chiral auxiliary are prepared and examined for their stereoselectivity. Considerations based on both the absolute configuration of the product phosphates as well as the X-ray structural determination of one of the bis(2,4-dichlorophenyl) phosphoramidates suggest these substitutions occur with preponderant inversion of configuration at phosphorus.

LARGE SCALE PREPARATION OF VERSATILE CHIRAL AUXILIARIES DERIVED FROM (S)-PROLINE

Enders, Dieter,Kipphardt, Helmut,Gerdes, Peter,Brena-Valle, Leonardo J.,Bhushan, Vidya

, p. 691 - 704 (2007/10/02)

The synthesis of a variety of enantiomerically pure chiral auxiliaries based on (S)-proline and bearing sterically demanding side chains at the pyrrolidine moiety, such as the secondary amines (S)-3,5 and 7 and the hydrazines (S)-6, is described on a molar scale.As key step, the Grignard or RLi addition to the N-benzylated proline ester (S)-1 is used.

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