1-Chlorophthalazine - ≥97% , CAS No.5784-45-2

CAS: 5784-45-2 Cat. No.: C589546 Molecular Weight: 164.59 EC Number: 676-559-5
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
I1IE9W0S0C | 1chlorophthalazine | DTXSID20206547 | BS-13386 | UCOVESIAFFGEOR-UHFFFAOYSA-N | 1-Chlorophthalazine | 1-Chloro-phthalazine | EC-000.1837 | HMS1789H04 | SCHEMBL147684 | 1-chlorophthalazin | A869571 | AB01425 | FT-0635849 | NSC 71104 | Phthalazi
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
100mg
C589546-100mg
2

$44.90

$67.90
Save $23.00 (33.87%)
250mg
C589546-250mg
1

$78.90

$118.90
Save $40.00 (33.64%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Argon charged Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

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

📚

Literature proof

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

Overview

Application:

1-Chlorophthalazine, is used as a pharmaceutical intermediate and are used as medical isotopes.

Specifications

Synonyms
I1IE9W0S0C | 1chlorophthalazine | DTXSID20206547 | BS-13386 | UCOVESIAFFGEOR-UHFFFAOYSA-N | 1-Chlorophthalazine | 1-Chloro-phthalazine | EC-000.1837 | HMS1789H04 | SCHEMBL147684 | 1-chlorophthalazin | A869571 | AB01425 | FT-0635849 | NSC 71104 | Phthalazi
Specifications & Purity
≥97%
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
≥97%
Names and Identifiers
Pubchem Sid504757494
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504757494
Canonical SmilesC1=CC=C2C(=C1)C=NN=C2Cl
IUPAC Name1-chlorophthalazine
InChIKeyUCOVESIAFFGEOR-UHFFFAOYSA-N
INCHI1S/C8H5ClN2/c9-8-7-4-2-1-3-6(7)5-10-11-8/h1-5H
Isomeric SMILES C1=CC=C2C(=C1)C=NN=C2Cl
Molecular Weight 164.59
Reaxy-Rn 119683
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=119683&ln=

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.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassDiazanaphthalenes
SubclassBenzodiazines
Intermediate Tree Nodes Not available
Direct ParentPhthalazines
Alternative Parents Pyridazines and derivatives  Benzenoids  Aryl chlorides  Heteroaromatic compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Phthalazine - Benzenoid - Pyridazine - Aryl halide - Aryl chloride - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phthalazines. These are compounds containing a phthalazine moiety, which consists of a benzene ring fused to a pyridazine, forming a 2,3-benzodiazine skeleton.
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:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot NumberCertificate TypeDateItem
K2302379Certificate of AnalysisSep 21, 2023 C589546
K2302380Certificate of AnalysisSep 21, 2023 C589546
K2302384Certificate of AnalysisSep 21, 2023 C589546
K2302388Certificate of AnalysisSep 21, 2023 C589546
Chemical and Physical Properties
SolubilityInsoluble in water. Soluble in dichloromethane, ethanol and methanol.
SensitivityMoisture sensitive
Melt Point(°C)109-112℃
Molecular Weight164.590 g/mol
XLogP32.100
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass164.014 Da
Monoisotopic Mass164.014 Da
Topological Polar Surface Area25.800 Ų
Heavy Atom Count11
Formal Charge0
Complexity140.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
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
Reviews

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