2-(3,5-Dichlorophenyl)propan-2-amine - ≥98% , CAS No.129960-45-8

CAS: 129960-45-8 Cat. No.: P725685 Molecular Weight: 204.09 EC Number: 815-056-9 PubChem CID: 11195052
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
2-(3,5-dichlorophenyl)-2-propanamine
Storage
Protected from light,Room temperature,Argon charged,Desiccated,Cool
Shipped In
Normal
Size
Status
Price
Qty
250mg
P725685-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$25.90
1g
P725685-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$64.90
5g
P725685-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$194.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Protected from light,Room temperature,Argon charged,Desiccated,Cool Ships Normal 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.

Specifications

Synonyms
2-(3, 5-dichlorophenyl)-2-propanamine
Specifications & Purity
≥98%
Storage
Protected from light, Room temperature, Argon charged, Desiccated, Cool
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Canonical SmilesCC(C)(C1=CC(=CC(=C1)Cl)Cl)N
IUPAC Name2-(3,5-dichlorophenyl)propan-2-amine
InChIKeyAZEJGVWRTXUSHS-UHFFFAOYSA-N
INCHI1S/C9H11Cl2N/c1-9(2,12)6-3-7(10)5-8(11)4-6/h3-5H,12H2,1-2H3
Isomeric SMILES CC(C)(C1=CC(=CC(=C1)Cl)Cl)N
PubChem CID 11195052
Molecular Weight 204.09

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
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassPhenylpropanes
Intermediate Tree Nodes Not available
Direct ParentPhenylpropanes
Alternative Parents Dichlorobenzenes  Aralkylamines  Aryl chlorides  Organochlorides  Monoalkylamines  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenylpropane - 1,3-dichlorobenzene - Aralkylamine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Amine - Organohalogen compound - Primary aliphatic amine - Organochloride - Organonitrogen compound - Primary amine - Hydrocarbon derivative - Organic nitrogen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenylpropanes. These are organic compounds containing a phenylpropane moiety.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(non-human)
Plasmodium falciparum (966862 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Sensitivitylight sensitive
Molecular Weight204.090 g/mol
XLogP32.600
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass203.027 Da
Monoisotopic Mass203.027 Da
Topological Polar Surface Area26.000 Ų
Heavy Atom Count12
Formal Charge0
Complexity149.000
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
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