1-Isopropylimidazole - ≥97%(GC) , CAS No.4532-96-1

CAS: 4532-96-1 Cat. No.: I157587 Molecular Weight: 110.16 EC Number: 805-859-2
AVAILABLE TO ORDER
GRADE & PURITY ≥97%(GC)
Synonyms
1-(propan-2-yl)-1H-imidazole | 1-Isopropylimidazole | DTXSID4074645 | IPIORGCOGQZEHO-UHFFFAOYSA-N | I0845 | STL583906 | FT-0659139 | EN300-79714 | 1-Isopropyl-1H-imidazole | AC-4502 | 3-(5-OXO-3-THIOXO-2,3,4,5-TETRAHYDRO-[1,2,4]TRIAZIN-6-YL)-PROPIONICACID
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5g
I157587-5g
10
$9.90
25g
I157587-25g
6
$10.90
100g
I157587-100g
5

$20.90

$31.90
Save $11.00 (34.48%)
500g
I157587-500g
2

$72.90

$109.90
Save $37.00 (33.67%)
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Why this grade

≥97%(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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
1-(propan-2-yl)-1H-imidazole | 1-Isopropylimidazole | DTXSID4074645 | IPIORGCOGQZEHO-UHFFFAOYSA-N | I0845 | STL583906 | FT-0659139 | EN300-79714 | 1-Isopropyl-1H-imidazole | AC-4502 | 3-(5-OXO-3-THIOXO-2, 3, 4, 5-TETRAHYDRO-[1, 2, 4]TRIAZIN-6-YL)-PROPIONICACID
Specifications & Purity
≥97%(GC)
Storage
Room temperature
Shipped In
Normal
Purity
≥97%(GC)
Names and Identifiers
Pubchem Sid488196567
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488196567
Canonical SmilesCC(C)N1C=CN=C1
IUPAC Name1-propan-2-ylimidazole
InChIKeyIPIORGCOGQZEHO-UHFFFAOYSA-N
INCHI1S/C6H10N2/c1-6(2)8-4-3-7-5-8/h3-6H,1-2H3
Isomeric SMILES CC(C)N1C=CN=C1
Molecular Weight 110.16
Reaxy-Rn 605965
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=605965&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.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassAzoles
SubclassImidazoles
Intermediate Tree Nodes Substituted imidazoles
Direct ParentN-substituted imidazoles
Alternative Parents Heteroaromatic compounds  Azacyclic compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents N-substituted imidazole - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as n-substituted imidazoles. These are heterocyclic compounds containing an imidazole ring substituted at position 1.
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.

14 results found

Lot NumberCertificate TypeDateItem
K1714073Certificate of AnalysisJun 16, 2025 I157587
F1709169Certificate of AnalysisJan 07, 2025 I157587
H1929097Certificate of AnalysisJun 07, 2023 I157587
E2308084Certificate of AnalysisMay 13, 2023 I157587
F2325857Certificate of AnalysisMay 11, 2023 I157587
F2325861Certificate of AnalysisMay 11, 2023 I157587
F2325870Certificate of AnalysisMay 11, 2023 I157587
F2325883Certificate of AnalysisMay 11, 2023 I157587
F2325889Certificate of AnalysisMay 11, 2023 I157587
F2325916Certificate of AnalysisMay 11, 2023 I157587
F2325919Certificate of AnalysisMay 11, 2023 I157587
D2315469Certificate of AnalysisApr 25, 2023 I157587
D2315710Certificate of AnalysisDec 14, 2021 I157587
K2110821Certificate of AnalysisDec 14, 2021 I157587

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Chemical and Physical Properties
Refractive Index1.48
Flash Point(°C)77 °C
Boil Point(°C)104°C/7mmHg
Molecular Weight110.160 g/mol
XLogP30.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass110.084 Da
Monoisotopic Mass110.084 Da
Topological Polar Surface Area17.800 Ų
Heavy Atom Count8
Formal Charge0
Complexity70.900
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
Citations of This Product
References
1. Xianqiang Huang, Sen Liu, Gang Liu, Yiwei Tao, Chenran Wang, Yalin Zhang, Zhen Li, Huaiwei Wang, Zhen Zhou, Guodong Shen, Zechun Xue, Di Sun.  (2022)  An unprecedented 2-fold interpenetrated lvt open framework built from Zn6 ring seamed trivacant polyoxotungstates used for photocatalytic synthesis of pyridine derivatives.  APPLIED CATALYSIS B-ENVIRONMENTAL,      [PMID:] [10.1016/j.apcatb.2022.122134]
2. Xianqiang Huang, Yuquan Qi, Yuxiao Gu, Shuwen Gong, Guodong Shen, Qiang Li, Jikun Li.  (2020)  Imidazole-directed fabrication of three polyoxovanadate-based copper frameworks as efficient catalysts for constructing C–N bonds.  DALTON TRANSACTIONS,  49  (31): (10970-10976).  [PMID:32725036] [10.1039/D0DT02162H]
Solution Calculators
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