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5-(Hydroxymethyl)-1H-pyrrole-2-carbaldehyde - ≥95%, high purity , CAS No.67350-50-9

    Grade & Purity:
  • ≥95%
In stock
Item Number
H726805
Grouped product items
SKU Size
Availability
Price Qty
H726805-25mg
25mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$131.90
H726805-100mg
100mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$390.90
H726805-250mg
250mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$645.90

Basic Description

Specifications & Purity ≥95%

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organic oxygen compounds
Class Organooxygen compounds
Subclass Carbonyl compounds
Intermediate Tree Nodes Aldehydes
Direct Parent Aryl-aldehydes
Alternative Parents Substituted pyrroles  Heteroaromatic compounds  Azacyclic compounds  Primary alcohols  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Aromatic alcohols  
Molecular Framework Aromatic heteromonocyclic compounds
Substituents Aryl-aldehyde - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic alcohol - Primary alcohol - Organonitrogen compound - Alcohol - Aromatic heteromonocyclic compound
Description This compound belongs to the class of organic compounds known as aryl-aldehydes. These are compounds containing an aldehyde group directly attached to an aromatic ring.
External Descriptors pyrroles

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

IUPAC Name 5-(hydroxymethyl)-1H-pyrrole-2-carbaldehyde
INCHI InChI=1S/C6H7NO2/c8-3-5-1-2-6(4-9)7-5/h1-3,7,9H,4H2
InChIKey SRPREECLSOIPNK-UHFFFAOYSA-N
Smiles C1=C(NC(=C1)C=O)CO
Isomeric SMILES C1=C(NC(=C1)C=O)CO
Alternate CAS 67350-50-9
PubChem CID 12416228
Molecular Weight 125.13

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Chemical and Physical Properties

Molecular Weight 125.130 g/mol
XLogP3 -0.300
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 125.048 Da
Monoisotopic Mass 125.048 Da
Topological Polar Surface Area 53.100 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 105.000
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

Solution Calculators

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