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2,3-Dihydro-1H-pyrrolo[2,3-b]pyridine-5-carbonitrile is a heterocyclic chemical compound with the molecular formula C8H6N4. It features a pyrrolopyridine ring system with a cyano group attached to the fifth carbon. 2,3-DIHYDRO-1H-PYRROLO[2,3-B]PYRIDINE-5-CARBONITRILE is of interest in medicinal and organic chemistry due to its potential biological activities and its utility as a scaffold for designing new drug molecules.

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  • 267413-07-0 Structure
  • Basic information

    1. Product Name: 2,3-DIHYDRO-1H-PYRROLO[2,3-B]PYRIDINE-5-CARBONITRILE
    2. Synonyms: 2,3-DIHYDRO-1H-PYRROLO[2,3-B]PYRIDINE-5-CARBONITRILE;1H-Pyrrolo[2,3-b]pyridine-5-carbonitrile,2,3-dihydro-(9CI)
    3. CAS NO:267413-07-0
    4. Molecular Formula: C8H7N3
    5. Molecular Weight: 145.16
    6. EINECS: N/A
    7. Product Categories: PYRIDINE
    8. Mol File: 267413-07-0.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 303.1°C at 760 mmHg
    3. Flash Point: 137.1°C
    4. Appearance: /
    5. Density: 1.18g/cm3
    6. Vapor Pressure: 0.00095mmHg at 25°C
    7. Refractive Index: 1.615
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. PKA: 4.16±0.20(Predicted)
    11. CAS DataBase Reference: 2,3-DIHYDRO-1H-PYRROLO[2,3-B]PYRIDINE-5-CARBONITRILE(CAS DataBase Reference)
    12. NIST Chemistry Reference: 2,3-DIHYDRO-1H-PYRROLO[2,3-B]PYRIDINE-5-CARBONITRILE(267413-07-0)
    13. EPA Substance Registry System: 2,3-DIHYDRO-1H-PYRROLO[2,3-B]PYRIDINE-5-CARBONITRILE(267413-07-0)
  • 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: 267413-07-0(Hazardous Substances Data)

267413-07-0 Usage

Uses

Used in Pharmaceutical Research:
2,3-Dihydro-1H-pyrrolo[2,3-b]pyridine-5-carbonitrile is used as a chemical scaffold for pharmaceutical research, serving as a foundation for the development of new drug molecules. Its unique structure and potential biological activities make it a valuable compound in the search for novel therapeutic agents.
Used in Drug Development:
In the field of drug development, 2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-5-carbonitrile is utilized as a starting point for creating new pharmaceutical compounds. Its chemical properties and potential applications in medicine make it a promising candidate for further exploration and synthesis of potential drugs.

Check Digit Verification of cas no

The CAS Registry Mumber 267413-07-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,6,7,4,1 and 3 respectively; the second part has 2 digits, 0 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 267413-07:
(8*2)+(7*6)+(6*7)+(5*4)+(4*1)+(3*3)+(2*0)+(1*7)=140
140 % 10 = 0
So 267413-07-0 is a valid CAS Registry Number.
InChI:InChI=1/C9H8N2/c1-2-7-5-8-3-4-10-9(8)11-6-7/h1,5-6H,3-4H2,(H,10,11)

267413-07-0SDS

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 2,3-DIHYDRO-1H-PYRROLO[2,3-B]PYRIDINE-5-CARBONITRILE

1.2 Other means of identification

Product number -
Other names 7-aza-5-cyanoindoline

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:267413-07-0 SDS

267413-07-0Relevant articles and documents

Histone deacetylase inhibitors and its preparation method and use thereof

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Paragraph 0127; 0129; 0133; 0134; 0135, (2019/05/15)

The invention discloses a histone deacetylase inhibitor and its preparation method and use, the invention discloses a compound of the formula I as shown, or its crystalline form, or its pharmaceutically acceptable salt, or solvate thereof, or prodrug thereof, or its metabolic product. The invention of the formula I illustrated new compound, has shown good deacetylase inhibition activity, with the histone deacetylase for clinical treatment of diseases associated with abnormal activity of a new pharmaceutical may be.

An expedient Pd/DBU mediated cyanation of aryl/heteroaryl bromides with K4[Fe(CN)6]

Zhang, Dengyou,Sun, Haifeng,Zhang, Lei,Zhou, Yu,Li, Chunpu,Jiang, Hualiang,Chen, Kaixian,Liu, Hong

supporting information; experimental part, p. 2909 - 2911 (2012/03/27)

A practical Pd(PPh3)4/DBU catalytic system for the synthesis of pharmaceutically relevant aminopyridine nitrile intermediates, as well as a variety of other aryl nitriles using non-toxic K4[Fe(CN) 6] has been developed. The key features of our new protocol for cyanation lie in that the reaction can be carried out with readily available Pd(PPh3)4 under mild and green conditions, even without the assistance of other ligands. The Royal Society of Chemistry 2012.

NOVEL ANTIMALARIA AGENT CONTAINING HETEROCYCLIC COMPOUND

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Page/Page column 60-61, (2008/06/13)

Disclosed is an antimalarial agent containing a compound represented by the formula: [wherein A1 represents a 3-pyridyl group that may have a substituent, a 6-quinolyl group that may have a substituent, or the like; X1 represents a group represented by the formula -C(=O)-NH- or the like; E represents a furyl group, a thienyl group or a phenyl group; with the proviso that A1 may have one to three substituents, and E has one of two substituents] or a salt thereof or hydrates thereof.

NOVEL ANTIFUNGAL AGENT COMPRISING HETEROCYCLIC COMPOUND

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Page/Page column 68, (2010/11/08)

The present invention provides an antifungal agent represented by the formula: [wherein A1 represents a 3-pyridyl group which may have a substituent, a quinolyl group which may have a substituent, or the like; X1 represents a group represented by the formula -NH-C(=O)-, a group represented by the formula -C(=O)-NH-, or the like; E represents a furyl group, a thienyl group, a pyrrolyl group, a phenyl group, a pyridyl group, a tetrazolyl group, a thiazolyl group or a pyrazolyl group; with the proviso that A1 may have 1 to 3 substituents, and E has one or two substituents].

Thrombin inhibitors

-

, (2008/06/13)

Compounds of the invention are useful in inhibiting thrombin and associated thrombotic occlusions having the following structure: or a pharmaceutically acceptable salt thereof, wherein b is NY or O; c is CY2or N; d is CY3or N; e is CY4or N; f is CY5or N; g is CY6or N; Y4, Y5, and Y6are independently hydrogen, C1-4alkyl, or halogen; Y1and Y2are independently hydrogen, C1-4alkyl, C3-7cycloalkyl, halogen, NH2, OH or C1-4alkoxy, and Y3is hydrogen, C1-4alkyl, C3-7cycloalkyl, halogen, —CN, NH2, OH or C1-4alkoxy; A is and W, W1, R1, R3, R4, R5, X and Z are defined in the specification.

Azaindoles: Moderately basic P1 groups for enhancing the selectivity of thrombin inhibitors

Sanderson, Philip E. J.,Stanton, Matthew G.,Dorsey, Bruce D.,Lyle, Terry A.,McDonough, Colleen,Sanders, William M.,Savage, Kelly L.,Naylor-Olsen, Adel M.,Krueger, Julie A.,Lewis, S. Dale,Lucas, Bobby J.,Lynch, Joseph J.,Yan, Youwei

, p. 795 - 798 (2007/10/03)

Starting from a 2-amino-6-methylpyridine P1 group and following a strategy of enlarging it whilst reducing its polarity, we have developed a series of potent, moderately basic azaindoles which are intrinsically much more selective for thrombin versus tryp

THROMBIN INHIBITORS

-

, (2008/06/13)

Compounds of the invention are useful in inhibiting thrombin and associated thrombotic occlusions having the following structure: or a pharmaceutically acceptable salt thereof, wherein b is N Y 1 or O; c is CY 2 or N; d is CY 2; e is CY 1 or N; f is CY 1 or N; g is CY 1 or N; Y 1 is hydrogen, C 1-4 alkyl, or halogen; Y 2 is hydrogen, C 1-4 alkyl, C 3-7 cycloalkyl, halogen, NH 2, OH or C 1-4 alkoxy;A is and W, X, Z, R 3, R 4 and R 5 are defined in the specification.

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