Indophenol , CAS No.500-85-6

CAS: 500-85-6 Cat. No.: I133727 Molecular Weight: 199.205 EC Number: 207-913-5
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Synonyms
Benzenoneindophenol | DTXSID2075425 | CHEBI:50428 | INDOPHENOL | AKOS015916568 | 4-[(4-hydroxyphenyl)imino]cyclohexa-2,5-dien-1-one | 4-[(4-Hydroxyphenyl)imino]-2,5-cyclohexadien-1-one # | FT-0627230 | A827967 | EINECS 207-913-5 | MFCD00001621 | UNII-BW44
Storage
Protected from light,Room temperature
Shipped In
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I133727-1g
2
$209.90
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Why this grade

for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Protected from light,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
Benzenoneindophenol | DTXSID2075425 | CHEBI:50428 | INDOPHENOL | AKOS015916568 | 4-[(4-hydroxyphenyl)imino]cyclohexa-2, 5-dien-1-one | 4-[(4-Hydroxyphenyl)imino]-2, 5-cyclohexadien-1-one # | FT-0627230 | A827967 | EINECS 207-913-5 | MFCD00001621 | UNII-BW44
Storage
Protected from light, Room temperature
Shipped In
Normal
Names and Identifiers
Canonical SmilesC1=CC(=O)C=CC1=NC2=CC=C(C=C2)O
IUPAC Name4-(4-hydroxyphenyl)iminocyclohexa-2,5-dien-1-one
InChIKeyRSAZYXZUJROYKR-UHFFFAOYSA-N
INCHI1S/C12H9NO2/c14-11-5-1-9(2-6-11)13-10-3-7-12(15)8-4-10/h1-8,14H
Isomeric SMILES C1=CC(=O)C=CC1=NC2=CC=C(C=C2)O
Molecular Weight 199.205
Reaxy-Rn 2095656
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2095656&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.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic nitrogen compounds
ClassOrganonitrogen compounds
SubclassQuinonimines
Intermediate Tree Nodes Not available
Direct ParentP-quinonimines
Alternative Parents 1-hydroxy-2-unsubstituted benzenoids  Benzene and substituted derivatives  Secondary ketimines  Azomethines  Cyclic ketones  Propargyl-type 1,3-dipolar organic compounds  Organopnictogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents P-quinonimine - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Benzenoid - Azomethine - Secondary ketimine - Ketimine - Ketone - Cyclic ketone - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Imine - Carbonyl group - Organopnictogen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as p-quinonimines. These are quinonimines in which the imine groups are in a para-relationship.
External Descriptors quinone imine
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.

7 results found

Lot NumberCertificate TypeDateItem
G2219685Certificate of AnalysisFeb 04, 2026 I133727
A2219344Certificate of AnalysisAug 11, 2025 I133727
G2329439Certificate of AnalysisMay 12, 2025 I133727
D2308246Certificate of AnalysisJan 09, 2025 I133727
G2329321Certificate of AnalysisMar 09, 2023 I133727
D2308235Certificate of AnalysisFeb 22, 2023 I133727
F1920236Certificate of AnalysisFeb 03, 2023 I133727
Chemical and Physical Properties
Sensitivitylight sensitive
Molecular Weight199.200 g/mol
XLogP31.500
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass199.063 Da
Monoisotopic Mass199.063 Da
Topological Polar Surface Area49.700 Ų
Heavy Atom Count15
Formal Charge0
Complexity316.000
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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