4-Chlorochalcone - ≥97% , CAS No.956-04-7

CAS: 956-04-7 Cat. No.: C469903 분자식: C15H11ClO 분자량: 242.7 EC 번호: 213-476-1
주문 가능
GRADE & PURITY ≥97%
Synonyms
Z46028359 | MS-11493 | 2-Propen-1-one, 3-(4-chlorophenyl)-1-phenyl-, (E)- | A845348 | 2-07-00-00427 (Beilstein Handbook Reference) | BRN 1745068 | 4-Chlorochalcone, (E)- | 3-(4-chlorophenyl)-1-phenylprop-2-en-1-one | MFCD00016345 | AKOS001377258 | AKOS025
Storage
Store at 2-8°C
Shipped In
Wet ice
★
Size
USA
독일 (EU)*
Price
Qty
1g
C469903-1g
7 재고 있음
—

US$13.90

US$20.90
저장 US$7.00 (33.49%)
5g
C469903-5g
5 재고 있음
—

US$61.90

US$92.90
저장 US$31.00 (33.37%)
25g
C469903-25g
4 재고 있음
—

US$74.90

US$112.90
저장 US$38.00 (33.66%)
100g
C469903-100g
2 재고 있음
—

US$239.90

US$359.90
저장 US$120.00 (33.34%)
Enter a quantity for the sizes you want to add.
🧪

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.

개요

Description

4-Chlorochalcone is a chalcone derivative. Its crystals exhibit monoclinic system with space groupP21/c. It can undergo conjugate addition reaction with pyrrole in the presence of AlKIT-5 (mesoporous 3D aluminosilicate catalyst) to form the corresponding C2-alkylated pyrrole derivatives.

Specifications

동의어
Z46028359 | MS-11493 | 2-Propen-1-one, 3-(4-chlorophenyl)-1-phenyl-, (E)- | A845348 | 2-07-00-00427 (Beilstein Handbook Reference) | BRN 1745068 | 4-Chlorochalcone, (E)- | 3-(4-chlorophenyl)-1-phenylprop-2-en-1-one | MFCD00016345 | AKOS001377258 | AKOS025
사양 및 순도
≥97%
보관 조건
Store at 2-8°C
배송
Wet ice
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순수함
≥97%
이름과 식별자
Pubchem Sid488195520
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488195520
정식 스마일C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)Cl
IUPAC Name(E)-3-(4-chlorophenyl)-1-phenylprop-2-en-1-one
InChIKeyABGIIXRNMHUKII-DHZHZOJOSA-N
INCHI1S/C15H11ClO/c16-14-9-6-12(7-10-14)8-11-15(17)13-4-2-1-3-5-13/h1-11H/b11-8+
이성체 SMILES C1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)Cl
분자량 242.7
Reaxy-Rn 1105953
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1105953&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
SuperclassPhenylpropanoids and polyketides
분류Linear 1,3-diarylpropanoids
SubclassChalcones and dihydrochalcones
Intermediate Tree Nodes Not available
Direct ParentRetrochalcones
Alternative Parents Styrenes  Benzoyl derivatives  Aryl ketones  Chlorobenzenes  Aryl chlorides  Enones  Acryloyl compounds  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Retrochalcone - Benzoyl - Styrene - Aryl ketone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Enone - Acryloyl-group - Alpha,beta-unsaturated ketone - Ketone - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - Organooxygen compound - Aromatic homomonocyclic compound
설명This compound belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors monochlorobenzenes - chalcones
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.

8 results found

Lot NumberCertificate Type날짜항목
F2314547Certificate of AnalysisMar 18, 2026 C469903
F2314550Certificate of AnalysisMar 18, 2026 C469903
F2314554Certificate of AnalysisMar 18, 2026 C469903
F2314555Certificate of AnalysisMar 18, 2026 C469903
F2314556Certificate of AnalysisMar 18, 2026 C469903
F2314588Certificate of AnalysisMar 18, 2026 C469903
F2314063Certificate of AnalysisMay 18, 2023 C469903
F2314068Certificate of AnalysisMay 18, 2023 C469903
화학 및 물리적 특성
녹는점(°C)113-117 °C (lit.)
분자량242.700 g/mol
XLogP33.700
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass242.05 Da
Monoisotopic Mass242.05 Da
Topological Polar Surface Area17.100 Ų
Heavy Atom Count17
Formal Charge0
Complexity271.000
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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