4-Chloro-7-(2-c-methyl-beta-d-ribofuranosyl)-7h-pyrrolo[2,3-d]pyrimidine - ≥95% , CAS No.443642-33-9

CAS: 443642-33-9 Cat. No.: C997396 PubChem CID: 10357409
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Storage
Room temperature
 ·  off list, applied to all prices below.
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Status
Price
Qty
100mg
C997396-100mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$975.90
250mg
C997396-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$1,950.90
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Specifications & Purity
≥95%
Storage
Room temperature
Purity
≥95%
Names and Identifiers
Canonical SmilesCC1(C(C(OC1N2C=CC3=C2N=CN=C3Cl)CO)O)O
IUPAC Name(2R,3R,4R,5R)-2-(4-chloropyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)-3-methyloxolane-3,4-diol
InChIKeyYNVCLSAXHSBSTK-GAJNKVMBSA-N
INCHI1S/C12H14ClN3O4/c1-12(19)8(18)7(4-17)20-11(12)16-3-2-6-9(13)14-5-15-10(6)16/h2-3,5,7-8,11,17-19H,4H2,1H3/t7-,8-,11-,12-/m1/s1
Isomeric SMILES C[C@]1([C@@H]([C@H](O[C@H]1N2C=CC3=C2N=CN=C3Cl)CO)O)O
PubChem CID 10357409

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassNucleosides, nucleotides, and analogues
ClassPyrrolopyrimidine nucleosides and nucleotides
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentPyrrolopyrimidine nucleosides and nucleotides
Alternative Parents Glycosylamines  Pentoses  Pyrrolo[2,3-d]pyrimidines  Halopyrimidines  Substituted pyrroles  Aryl chlorides  Tertiary alcohols  Oxolanes  Heteroaromatic compounds  Secondary alcohols  1,2-diols  Oxacyclic compounds  Azacyclic compounds  Hydrocarbon derivatives  Organochlorides  Organonitrogen compounds  Primary alcohols  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Pyrrolopyrimidine ribonucleoside - Glycosyl compound - N-glycosyl compound - Pentose monosaccharide - Pyrrolo[2,3-d]pyrimidine - Pyrrolopyrimidine - Halopyrimidine - Substituted pyrrole - Pyrimidine - Aryl chloride - Aryl halide - Monosaccharide - Tertiary alcohol - Heteroaromatic compound - Pyrrole - Oxolane - Secondary alcohol - 1,2-diol - Organoheterocyclic compound - Oxacycle - Azacycle - Primary alcohol - Organohalogen compound - Organochloride - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Alcohol - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as pyrrolopyrimidine nucleosides and nucleotides. These are nucleoside derivatives containing a ribose derivative which is n-glycosylated to a pyrrolopyrimidine. Also called deazapurine nucleosides, they are analogs of purine nucleosides with the N atom of the purine being replaced by a C atom at position 7.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight299.710 g/mol
XLogP30.200
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass299.067 Da
Monoisotopic Mass299.067 Da
Topological Polar Surface Area101.000 Ų
Heavy Atom Count20
Formal Charge0
Complexity377.000
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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