6-Azaindole - ≥98%(HPLC) , CAS No.271-29-4

CAS: 271-29-4 Cat. No.: A140209 Formula: C₇H₆N₂ Molecular Weight: 118.14 Beilstein Registry Number: 109685 EC Number: 664-233-5

GRADE & PURITY ≥98%(HPLC)

Synonyms

1H-Inden-2-amine, 5,6-diethyl-2,3-dihydro-, hydrochloride (1:1) | SCHEMBL22959960 | 6H-PYRROLO[2,3-C]PYRIDINE | FT-0601477 | P2530 | SY005848 | BRN 0109685 | 1H-pyrrolo[2,3-c]pyridine | A-9495 | PS-4926 | 1H-Pyrrolo(2,3-c)pyridine | PB21773 | STL556838 |

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

1H-Inden-2-amine, 5,6-diethyl-2,3-dihydro-, hydrochloride (1:1) | SCHEMBL22959960 | 6H-PYRROLO[2,3-C]PYRIDINE | FT-0601477 | P2530 | SY005848 | BRN 0109685 | 1H-pyrrolo[2,3-c]pyridine | A-9495 | PS-4926 | 1H-Pyrrolo(2,3-c)pyridine | PB21773 | STL556838 |

Specifications & Purity

≥98%(HPLC)

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%(HPLC)

Names and Identifiers

Pubchem Sid

488180945

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180945

Canonical Smiles

C1=CNC2=C1C=CN=C2

IUPAC Name

1H-pyrrolo[2,3-c]pyridine

InChIKey

XLKDJOPOOHHZAN-UHFFFAOYSA-N

INCHI

1S/C7H6N2/c1-3-8-5-7-6(1)2-4-9-7/h1-5,9H

Isomeric SMILES

C1=CNC2=C1C=CN=C2

RTECS

UY8720000

Molecular Weight

118.14

Beilstein

109685

Reaxy-Rn

109685

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109685&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Pyrrolopyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Pyrrolopyridines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrrolopyridines
• Alternative Parents: Pyridines and derivatives Pyrroles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pyrrolopyridine - Pyridine - Heteroaromatic compound - Pyrrole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as pyrrolopyridines. These are compounds containing a pyrrolopyridine moiety, which consists of a pyrrole ring fused to a pyridine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in water (hardly), methanol and chloroform.
• Sensitivity: Air sensitive.Light sensitive.
• Molecular Weight: 118.140 g/mol
• XLogP3: 1.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 118.053 Da
• Monoisotopic Mass: 118.053 Da
• Topological Polar Surface Area: 28.700 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 103.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Frequently Asked Questions

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by HPLC. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 271-29-4, the molecular formula is C7H6N2, and the molecular weight is 118.14 g/mol. InChIKey XLKDJOPOOHHZAN-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.