3-Chloroiminodibenzyl - ≥98%(GC) , CAS No.32943-25-2

CAS: 32943-25-2 Cat. No.: C133801 Molecular Weight: 229.71 Beilstein Registry Number: 20(5)8,102 EC Number: 251-301-0
AVAILABLE TO ORDER
GRADE & PURITY ≥98%(GC)
Synonyms
mycophenilic acid | (1S,2S)-2-aminocyclopentanecarboxylic?acid | 3-CHLORO IMINODIBENZYL pound CHLORIMIPRAMINE pound(c) | 3-Chloroiminodibenzyl | SY036437 | EU-0075281 | UNII-0514QW7D2I | SR-01000465381 | 9-chloro-6,11-dihydro-5H-benzo[b][1]benzazepine
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5g
C133801-5g
3

$19.90

$29.90
Save $10.00 (33.44%)
25g
C133801-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$56.90

$85.90
Save $29.00 (33.76%)
100g
C133801-100g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$154.90

$232.90
Save $78.00 (33.49%)
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Why this grade

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

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Storage & shipping

Room temperature Ships Normal 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

Synonyms
mycophenilic acid | (1S, 2S)-2-aminocyclopentanecarboxylic?acid | 3-CHLORO IMINODIBENZYL pound CHLORIMIPRAMINE pound(c) | 3-Chloroiminodibenzyl | SY036437 | EU-0075281 | UNII-0514QW7D2I | SR-01000465381 | 9-chloro-6, 11-dihydro-5H-benzo[b][1]benzazepine
Specifications & Purity
≥98%(GC)
Storage
Room temperature
Shipped In
Normal
Purity
≥98%(GC)
Names and Identifiers
Canonical SmilesC1CC2=CC=CC=C2NC3=C1C=CC(=C3)Cl
IUPAC Name2-chloro-6,11-dihydro-5H-benzo[b][1]benzazepine
InChIKeyMHUXTOYYIDFXRF-UHFFFAOYSA-N
INCHI1S/C14H12ClN/c15-12-8-7-11-6-5-10-3-1-2-4-13(10)16-14(11)9-12/h1-4,7-9,16H,5-6H2
Isomeric SMILES C1CC2=CC=CC=C2NC3=C1C=CC(=C3)Cl
Molecular Weight 229.71
Beilstein 20(5)8,102
Reaxy-Rn 1314025
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1314025&ln=

Documentation

📋 Safety Data Sheet (SDS)

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

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✅ Certificate of Analysis (COA)

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

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassBenzazepines
SubclassDibenzazepines
Intermediate Tree Nodes Not available
Direct ParentDibenzazepines
Alternative Parents Azepines  Benzenoids  Aryl chlorides  Secondary amines  Azacyclic compounds  Organopnictogen compounds  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Dibenzazepine - Azepine - Benzenoid - Aryl halide - Aryl chloride - Azacycle - Secondary amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as dibenzazepines. These are compounds with two benzene rings connected by an azepine ring. Azepine is an unsaturated seven-member heterocycle with one nitrogen atom replacing a carbon atom.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
GLP1R Tclin Glucagon-like peptide 1 receptor (111429 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
POLI Tchem DNA polymerase iota (116820 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CBX1 Tbio Chromobox protein homolog 1 (92434 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:

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

1 results found

Lot NumberCertificate TypeDateItem
J1613020Certificate of AnalysisNov 13, 2025 C133801
Chemical and Physical Properties
SolubilitySoluble in Methanol
Melt Point(°C)87 °C
Molecular Weight229.700 g/mol
XLogP34.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass229.066 Da
Monoisotopic Mass229.066 Da
Topological Polar Surface Area12.000 Ų
Heavy Atom Count16
Formal Charge0
Complexity243.000
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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