Isobavachromene - ≥98% , CAS No.52801-22-6

CAS: 52801-22-6 Cat. No.: I664387 분자식: C20H18O4 분자량: 322.35
주문 가능
GRADE & PURITY ≥98%
Synonyms
1-(5-Hydroxy-2,2-dimethyl-2H-chromen-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one
Storage
Store at 2-8°C,Protected from light,Argon charged
Shipped In
Wet ice
★
Size
USA
독일 (EU)*
Price
Qty
1mg
I664387-1mg
주문제작 · 8~12주
US$49.90
5mg
I664387-5mg
주문제작 · 8~12주
US$119.90
10mg
I664387-10mg
주문제작 · 8~12주
US$179.90
25mg
I664387-25mg
주문제작 · 8~12주
US$379.90
50mg
I664387-50mg
주문제작 · 8~12주
US$529.90
100mg
I664387-100mg
주문제작 · 8~12주
US$769.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Protected from light,Argon charged 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.

개요

Isobavachromene is an antibacterial agent.

Specifications

동의어
1-(5-Hydroxy-2,2-dimethyl-2H-chromen-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one
사양 및 순도
≥98%
보관 조건
Store at 2-8°C,Protected from light,Argon charged
배송
Wet ice
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작업 유형
INHIBITOR
순수함
≥98%
이름과 식별자
정식 스마일CC1(C=CC2=C(O1)C=CC(=C2O)C(=O)C=CC3=CC=C(C=C3)O)C
IUPAC Name(E)-1-(5-hydroxy-2,2-dimethylchromen-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one
InChIKeyIQHPDUUSMBMDGN-WEVVVXLNSA-N
INCHI1S/C20H18O4/c1-20(2)12-11-16-18(24-20)10-8-15(19(16)23)17(22)9-5-13-3-6-14(21)7-4-13/h3-12,21,23H,1-2H3/b9-5+
이성체 SMILES CC1(C=CC2=C(O1)C=CC(=C2O)C(=O)/C=C/C3=CC=C(C=C3)O)C
대체 CAS 56083-03-5
분자량 322.35

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
SuperclassPhenylpropanoids and polyketides
분류Linear 1,3-diarylpropanoids
SubclassChalcones and dihydrochalcones
Intermediate Tree Nodes Not available
Direct Parent2'-Hydroxychalcones
Alternative Parents Hydroxycinnamic acids and derivatives  2,2-dimethyl-1-benzopyrans  Styrenes  Aryl ketones  Alkyl aryl ethers  1-hydroxy-4-unsubstituted benzenoids  1-hydroxy-2-unsubstituted benzenoids  Vinylogous acids  Enones  Acryloyl compounds  Oxacyclic compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents 2'-hydroxychalcone - Cinnamic acid or derivatives - Hydroxycinnamic acid or derivatives - 2,2-dimethyl-1-benzopyran - Benzopyran - 1-benzopyran - Styrene - Aryl ketone - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Enone - Vinylogous acid - Alpha,beta-unsaturated ketone - Ketone - Organoheterocyclic compound - Ether - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
설명This compound belongs to the class of organic compounds known as 2'-hydroxychalcones. These are organic compounds containing chalcone skeleton that carries a hydroxyl group at the 2'-position.
External Descriptors Chalcones and dihydrochalcones
3D 구조
상호 작용 화학 구조 모델





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작용 메커니즘
인증서(CoA, COO, BSE/TSE 및 분석 차트)
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.

6 results found

Lot NumberCertificate Type날짜항목
I2603766Certificate of AnalysisMar 28, 2026 I664387
I2603767Certificate of AnalysisMar 28, 2026 I664387
I2603768Certificate of AnalysisMar 28, 2026 I664387
I2603769Certificate of AnalysisMar 28, 2026 I664387
I2603770Certificate of AnalysisMar 28, 2026 I664387
I2603771Certificate of AnalysisMar 28, 2026 I664387
화학 및 물리적 특성
감도Moisture sensitive;Light sensitive
분자량322.400 g/mol
XLogP34.500
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass322.121 Da
Monoisotopic Mass322.121 Da
Topological Polar Surface Area66.800 Ų
Heavy Atom Count24
Formal Charge0
Complexity514.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds1
Covalently-Bonded Unit Count1
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