5-Acetyl-3-chloroiminodibenzyl

Name: 5-Acetyl-3-chloroiminodibenzyl
Brand: Vaqora Chemicals
SKU: VQ-031180

About 5-Acetyl-3-chloroiminodibenzyl

Listed under CAS 25961-11-9, 5-Acetyl-3-chloroiminodibenzyl is a process intermediate or related compound of Clomipramine available from Vaqora Chemicals. The compound has the formula C16H14ClNO, corresponding to a molecular weight of 271.74 g/mol. Its systematic (IUPAC) name is 1-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone. Alternative names: 3-Chloro-5-acetyliminodibenzyl and 5-Acetyl-3-chlor.

The product is provided as a solid. Reference materials should be stored sealed and away from light and moisture, as specified on the accompanying COA. The GHS classification uses the signal word “Warning”, so appropriate gloves, eye protection and ventilation are recommended.

Process chemists and analysts use it when developing synthetic routes to Clomipramine, tracking process-related impurities and validating analytical methods. It is used across pharmaceutical manufacturing and academic and industrial research.

Available in 10 mg, 25 mg, 50 mg and 100 mg packs, 5-Acetyl-3-chloroiminodibenzyl is dispatched with a Certificate of Analysis (COA) to destinations worldwide.

Typical applications

API route development
Impurity fate & purge studies
Analytical method development
Fine chemical synthesis

Industries

Related to Clomipramine

View every impurity, metabolite and intermediate we list for Clomipramine.

Clomipramine impurities

Specifications & identifiers

Chemical identifiers
Product name	5-Acetyl-3-chloroiminodibenzyl
Catalogue No.	VQ-031180
CAS Number	25961-11-9
IUPAC name	1-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone
Molecular formula	C₁₆H₁₄ClNO
Molecular weight	271.74 g/mol
Exact mass	271.0764
HSN code	2933
InChIKey	NMZOSOMVILZBJL-UHFFFAOYSA-N
SMILES	CC(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl
PubChem CID	117681

Physical properties
Physical form	Solid
LogP (XLogP3)	3.8
H-bond donors / acceptors	0 / 1
TPSA	20.3 Å²
Synonyms	5-Acetyl-3-chloro-10,11-dihydro-5H-dibenz[b,f]azepine, 1-(3-Chloro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)ethanone, 3-Chloro-5-acetyliminodibenzyl, 5-Acetyl-3-chloro-10,11-dihydro-5H-dibenz(b,f)azepine, Ethanone, 1-(3-chloro-10,11-dihydro-5H-dibenz[b,f]azepin-5-yl)-, 5-Acetyl-3-chloro-10,11-dihydrodibenzo[b,f]azepine, 1-(3-Chloro-10,11-dihydrodibenzo[b,f]azepin-5-yl)ethanone, 1-(3-Chloro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)ethan-1-one, 5-Acetyl-3-chlor, 5H-Dibenz[b,f]azepine, 5-acetyl-3-chloro-10,11-dihydro-, 5-Acetyl-3-chloro-2,2'-iminodibenzyl, 5-Acetyl-3-chloro-1011-dihydro-5H-dibenz[bf]azepine

Safety & hazard information (GHS)

Harmful / irritant

Signal word: Warning

Hazard statements

H315Causes skin irritation
H335May cause respiratory irritation

Precautionary statements: P261, P264, P271, P280, P302 + P352, P304 + P340, P319, P321, P332 + P317, P362 + P364, P403 + P233, P405, P501

Classification is indicative (aggregated GHS notifications) and may vary by grade and concentration. Always refer to the SDS supplied with your lot.

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Frequently asked questions

What is the CAS number of 5-Acetyl-3-chloroiminodibenzyl?

The CAS Registry Number of 5-Acetyl-3-chloroiminodibenzyl is 25961-11-9. It is also known as 5-Acetyl-3-chloro-10,11-dihydro-5H-dibenz[b,f]azepine, 1-(3-Chloro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)ethanone, 3-Chloro-5-acetyliminodibenzyl.

What is the molecular formula and molecular weight of 5-Acetyl-3-chloroiminodibenzyl?

5-Acetyl-3-chloroiminodibenzyl has the molecular formula C16H14ClNO and a molecular weight of 271.74 g/mol. Its IUPAC name is 1-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)ethanone.

What is 5-Acetyl-3-chloroiminodibenzyl used for?

5-Acetyl-3-chloroiminodibenzyl is supplied as a characterised reference material related to Clomipramine. It is used for analytical method development and validation (AMV), impurity profiling, stability studies and quality control, and in ANDA/DMF regulatory filings.

Which grade and pack sizes of 5-Acetyl-3-chloroiminodibenzyl can I order?

We supply 5-Acetyl-3-chloroiminodibenzyl, in 10 mg, 25 mg, 50 mg, 100 mg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with 5-Acetyl-3-chloroiminodibenzyl?

Yes. Every lot of 5-Acetyl-3-chloroiminodibenzyl is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can 5-Acetyl-3-chloroiminodibenzyl be shipped internationally?

Yes. 5-Acetyl-3-chloroiminodibenzyl is classified as hazardous, so it is packed in UN-approved packaging and shipped as dangerous goods under IATA/IMDG rules. We export worldwide on EXW, FOB, CIF and DAP terms.