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1H-Indole-1-carboxylic acid, 2-borono-5-[(4-methyl-1-piperazinyl)carbonyl]-, 1-(1,1-dimethylethyl) ester is a chemical with a specific purpose. Lookchem provides you with multiple data and supplier information of this chemical.

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  • 913388-57-5 Structure
  • Basic information

    1. Product Name: 1H-Indole-1-carboxylic acid, 2-borono-5-[(4-methyl-1-piperazinyl)carbonyl]-, 1-(1,1-dimethylethyl) ester
    2. Synonyms: 1H-Indole-1-carboxylic acid, 2-borono-5-[(4-methyl-1-piperazinyl)carbonyl]-, 1-(1,1-dimethylethyl) ester;LBGDJMZIAMJAMK-UHFFFAOYSA-N
    3. CAS NO:913388-57-5
    4. Molecular Formula: C19H26BN3O5
    5. Molecular Weight: 0
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 913388-57-5.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 594.6°C at 760 mmHg
    3. Flash Point: 313.4°C
    4. Appearance: /
    5. Density: 1.25g/cm3
    6. Vapor Pressure: 5.53E-15mmHg at 25°C
    7. Refractive Index: 1.589
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 1H-Indole-1-carboxylic acid, 2-borono-5-[(4-methyl-1-piperazinyl)carbonyl]-, 1-(1,1-dimethylethyl) ester(CAS DataBase Reference)
    11. NIST Chemistry Reference: 1H-Indole-1-carboxylic acid, 2-borono-5-[(4-methyl-1-piperazinyl)carbonyl]-, 1-(1,1-dimethylethyl) ester(913388-57-5)
    12. EPA Substance Registry System: 1H-Indole-1-carboxylic acid, 2-borono-5-[(4-methyl-1-piperazinyl)carbonyl]-, 1-(1,1-dimethylethyl) ester(913388-57-5)
  • 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: 913388-57-5(Hazardous Substances Data)

913388-57-5 Usage

Indole ring

A five-membered aromatic ring system with a nitrogen atom at one position.

Carboxylic acid group

A functional group consisting of a carbonyl group (C=O) and a hydroxyl group (-OH) bonded to the same carbon atom.

Boron atom

A metalloid element with the atomic number 5 and symbol B, present in the compound as a 2-borono group.

Piperazine moiety

A heterocyclic compound consisting of a six-membered ring with two nitrogen atoms at positions 1 and 4.

Ester functional group

A functional group formed by the esterification of a carboxylic acid with an alcohol, in this case, 1-(1,1-dimethylethyl) ester.

Tert-butyl group

A saturated hydrocarbon group with the formula C(CH3)3, esterified to the carboxylic acid group in this compound.

Potential pharmacological activity

The presence of various functional groups in the compound suggests potential activity in the field of medicinal chemistry and drug development.

Boron atom interactions

The boron atom in the compound may allow for interactions with biological targets, contributing to its potential pharmacological activity.

Piperazine group in pharmaceuticals

The presence of a piperazine group in the compound indicates its potential use as a drug molecule, as this group is commonly found in pharmaceutical compounds.

Check Digit Verification of cas no

The CAS Registry Mumber 913388-57-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 9,1,3,3,8 and 8 respectively; the second part has 2 digits, 5 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 913388-57:
(8*9)+(7*1)+(6*3)+(5*3)+(4*8)+(3*8)+(2*5)+(1*7)=185
185 % 10 = 5
So 913388-57-5 is a valid CAS Registry Number.
InChI:InChI=1/C19H26BN3O5/c1-19(2,3)28-18(25)23-15-6-5-13(11-14(15)12-16(23)20(26)27)17(24)22-9-7-21(4)8-10-22/h5-6,11-12,26-27H,7-10H2,1-4H3

913388-57-5SDS

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 [5-(4-methylpiperazine-1-carbonyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid

1.2 Other means of identification

Product number -
Other names 2-BORONO-5-[(4-METHYL-(PIPERAZIN-1-YL))CARBONYL]-1H-INDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

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:913388-57-5 SDS

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