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2-Butyl-5-chloro-1H-imidazole-4-carboxaldehyde - ≥98.0%(GC), high purity , CAS No.83857-96-9

COA

Grade & Purity:

≥98%(GC)

Cas Number: 83857-96-9
Molecular Weight: 186.64
MDL number: MFCD01934396
PubChem CID: 55176
PubChem SID: 488183387

In stock

Item Number

B133612

Grouped product items
SKU	Size	Availability	Price
B133612-5g	5g	5	$9.90
B133612-25g	25g	4	$28.90
B133612-100g	100g	4	$102.90
B133612-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$461.90

View related series

Halogenated heterocyclic block (1171) Imidazoles (222)

Basic Description

Synonyms	2-butyl -5-chloroimidazole-4-carbaldehyde \| LOSARTAN POTASSIUM IMPURITY D [EP IMPURITY] \| 2-Butyl-5-chloro-1H-imidazole-4-carboxaldehyde \| AKOS000264715 \| 2-n-Butyl-4-chloro-5-imidazolecarboxaldehyde \| B2914 \| 2-n-butyl-4-chloro-5-formylimidazole \| BP-103
Specifications & Purity	≥98%(GC)
Storage Temp	Argon charged
Shipped In	Normal
Product Description	2-Butyl-5-chloro-1H-imidazole-4-carboxaldehyde may be used in the preparation of the following symmetrical esters of dialkyl 4-(2-butyl-5-chloro-1H-imidazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate; · dimethyl 4-(2-butyl-5-chloro-1H-imidazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate · diethyl 4-(2-butyl-5-chloro-1H-imidazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate · diisopropyl 4-(2-butyl-5-chloro-1Himidazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate · diisobutyl 4-(2-butyl-5-chloro-1H-imidazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate · di-tert-butyl 4-(2-butyl-5-chloro-1Himidazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate · bis(2-methoxyethyl) 4-(2-butyl-5-chloro-1Himidazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azoles
    - Subclass Imidazoles
      - Level5 Substituted imidazoles
        Level6 Trisubstituted imidazoles
        Level7 2,4,5-trisubstituted imidazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azoles
Subclass	Imidazoles
Intermediate Tree Nodes	Substituted imidazoles - Trisubstituted imidazoles
Direct Parent	2,4,5-trisubstituted imidazoles
Alternative Parents	Carbonylimidazoles Aryl-aldehydes Aryl chlorides Vinylogous halides Vinylogous amides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	2,4,5-trisubstituted-imidazole - Imidazole-4-carbonyl group - Aryl-aldehyde - Aryl chloride - Aryl halide - Vinylogous halide - Vinylogous amide - Heteroaromatic compound - Azacycle - Organic oxygen compound - Aldehyde - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as 2,4,5-trisubstituted imidazoles. These are imidazoles in which the imidazole ring is substituted at positions 2, 4, and 5.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	488183387
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488183387
IUPAC Name	2-butyl-5-chloro-1H-imidazole-4-carbaldehyde
INCHI	InChI=1S/C8H11ClN2O/c1-2-3-4-7-10-6(5-12)8(9)11-7/h5H,2-4H2,1H3,(H,10,11)
InChIKey	JLVIHQCWASNXCK-UHFFFAOYSA-N
Smiles	CCCCC1=NC(=C(N1)Cl)C=O
Isomeric SMILES	CCCCC1=NC(=C(N1)Cl)C=O
WGK Germany	2
Molecular Weight	186.64
Reaxy-Rn	13767592
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=13767592&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

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Analytical Chart:

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9 results found

Lot Number	Certificate Type	Date	Item
E2326101	Certificate of Analysis	Mar 05, 2025	B133612
E2326110	Certificate of Analysis	Mar 05, 2025	B133612
E2406290	Certificate of Analysis	Apr 13, 2024	B133612
E2406291	Certificate of Analysis	Apr 13, 2024	B133612
K2120573	Certificate of Analysis	Sep 15, 2023	B133612
K2120128	Certificate of Analysis	Sep 15, 2023	B133612
F1924234	Certificate of Analysis	Jan 09, 2023	B133612
E2326109	Certificate of Analysis	Jan 09, 2023	B133612
C1723048	Certificate of Analysis	Aug 12, 2022	B133612

Chemical and Physical Properties

Solubility	Soluble in methanol
Sensitivity	Air sensitive
Melt Point(°C)	99℃
Molecular Weight	186.640 g/mol
XLogP3	2.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	186.056 Da
Monoisotopic Mass	186.056 Da
Topological Polar Surface Area	45.800 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	154.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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