4-Allylpyrocatechol - ≥97% , CAS No.1126-61-0

CAS: 1126-61-0 Cat. No.: A151341 Molecular Weight: 150.18 EC Number: 683-143-7
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
HY-N1887 | SY053072 | UNII-FG58C4J9BR | Hydroxychavicol | W-200844 | 1,2-Benzenediol, 4-(2-propenyl)- | 4-Allyl-1,2-dihydroxybenzene | BBL029399 | Fence rider | DTXSID20150112 | 2-Hydroxychavicol | 4-allylbenzene-1,2-d | CCRIS 1524 | STK046904 | AS-58835
Storage
Store at 2-8°C
Shipped In
Wet ice
Size
Status
Price
Qty
10mg
A151341-10mg
3

$11.90

$17.90
Save $6.00 (33.52%)
50mg
A151341-50mg
3

$41.90

$62.90
Save $21.00 (33.39%)
100mg
A151341-100mg
5

$75.90

$113.90
Save $38.00 (33.36%)
250mg
A151341-250mg
4

$164.90

$247.90
Save $83.00 (33.48%)
1g
A151341-1g
2

$434.90

$652.90
Save $218.00 (33.39%)
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
HY-N1887 | SY053072 | UNII-FG58C4J9BR | Hydroxychavicol | W-200844 | 1, 2-Benzenediol, 4-(2-propenyl)- | 4-Allyl-1, 2-dihydroxybenzene | BBL029399 | Fence rider | DTXSID20150112 | 2-Hydroxychavicol | 4-allylbenzene-1, 2-d | CCRIS 1524 | STK046904 | AS-58835
Specifications & Purity
≥97%
Storage
Store at 2-8°C
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
INHIBITOR
Purity
≥97%
Names and Identifiers
Pubchem Sid504754571
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504754571
Canonical SmilesC=CCC1=CC(=C(C=C1)O)O
IUPAC Name4-prop-2-enylbenzene-1,2-diol
InChIKeyFHEHIXJLCWUPCZ-UHFFFAOYSA-N
INCHI1S/C9H10O2/c1-2-3-7-4-5-8(10)9(11)6-7/h2,4-6,10-11H,1,3H2
Isomeric SMILES C=CCC1=CC(=C(C=C1)O)O
Molecular Weight 150.18
Reaxy-Rn 1937030
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1937030&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.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassPhenols
SubclassBenzenediols
Intermediate Tree Nodes Not available
Direct ParentCatechols
Alternative Parents 1-hydroxy-4-unsubstituted benzenoids  1-hydroxy-2-unsubstituted benzenoids  Benzene and substituted derivatives  Organooxygen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Catechol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as catechols. These are compounds containing a 1,2-benzenediol moiety.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
XDH Tclin Xanthine dehydrogenase (1038 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GAA Tclin Lysosomal alpha-glucosidase (35701 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Homo sapiens (32628 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HL-60 (67320 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MCF7 (126967 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NUGC (109 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PC-3 (62116 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SK-N-SH (1499 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HeLa (62764 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Liver microsomes (16955 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Streptococcus sanguinis (314 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Aggregatibacter actinomycetemcomitans (150 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Porphyromonas gingivalis (651 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Fusobacterium nucleatum (386 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Streptococcus mutans (2687 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Enterococcus faecium (13803 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Enterococcus faecalis (29875 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Actinomyces viscosus (309 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Caenorhabditis elegans (1055 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mus musculus (284745 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RAW264.7 (28094 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RBL-2H3 (1162 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
L929 (3802 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Prevotella intermedia (369 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.

11 results found

Lot NumberCertificate TypeDateItem
G2416069Certificate of AnalysisJun 11, 2024 A151341
F2301073Certificate of AnalysisMay 09, 2023 A151341
F2301077Certificate of AnalysisMay 09, 2023 A151341
F2301093Certificate of AnalysisMay 09, 2023 A151341
F2301099Certificate of AnalysisMay 09, 2023 A151341
F2301100Certificate of AnalysisMay 09, 2023 A151341
F2301102Certificate of AnalysisMay 09, 2023 A151341
F2301104Certificate of AnalysisMay 09, 2023 A151341
F2301107Certificate of AnalysisMay 09, 2023 A151341
F2301108Certificate of AnalysisMay 09, 2023 A151341
F2301109Certificate of AnalysisMay 09, 2023 A151341

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Chemical and Physical Properties
SensitivityHeat Sensitive
Boil Point(°C)123°C/2mmHg(lit.)
Melt Point(°C)44 °C
Molecular Weight150.170 g/mol
XLogP30.800
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass150.068 Da
Monoisotopic Mass150.068 Da
Topological Polar Surface Area40.500 Ų
Heavy Atom Count11
Formal Charge0
Complexity134.000
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
Reviews

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