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6-Iodochroman - ≥95%, high purity , CAS No.67856-45-5

    Grade & Purity:
  • ≥95%
In stock
Item Number
I725267
Grouped product items
SKU Size
Availability
Price Qty
I725267-100mg
100mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$225.90
I725267-250mg
250mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$394.90
I725267-1g
1g
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$806.90

Basic Description

Specifications & Purity ≥95%

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organoheterocyclic compounds
Class Benzopyrans
Subclass 1-benzopyrans
Intermediate Tree Nodes Not available
Direct Parent 1-benzopyrans
Alternative Parents Alkyl aryl ethers  Benzenoids  Aryl iodides  Oxacyclic compounds  Organoiodides  Hydrocarbon derivatives  
Molecular Framework Aromatic heteropolycyclic compounds
Substituents 1-benzopyran - Alkyl aryl ether - Benzenoid - Aryl iodide - Aryl halide - Oxacycle - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organoiodide - Organohalogen compound - Aromatic heteropolycyclic compound
Description This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.
External Descriptors Not available

Product Properties

ALogP 2.9

Names and Identifiers

IUPAC Name 6-iodo-3,4-dihydro-2H-chromene
INCHI InChI=1S/C9H9IO/c10-8-3-4-9-7(6-8)2-1-5-11-9/h3-4,6H,1-2,5H2
InChIKey LOHYOLMVKQWFIK-UHFFFAOYSA-N
Smiles C1CC2=C(C=CC(=C2)I)OC1
Isomeric SMILES C1CC2=C(C=CC(=C2)I)OC1
PubChem CID 10945163
Molecular Weight 260.07

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

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

Chemical and Physical Properties

Molecular Weight 260.070 g/mol
XLogP3 2.900
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 259.97 Da
Monoisotopic Mass 259.97 Da
Topological Polar Surface Area 9.200 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 138.000
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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