4-Nitrochalcone - ≥95%(HPLC) , CAS No.1222-98-6

CAS: 1222-98-6 Cat. No.: N159422 분자식: C15H11NO3 분자량: 253.26 Beilstein Registry Number: 7(2)429 EC 번호: 214-949-5
주문 가능
등급 & 순도 ≥95%(HPLC)
Synonyms
(E)-3-(4-Nitro-phenyl)-1-phenyl-propenone | NSC-27184 | DTXSID7049211 | MFCD00007382 | NSC636936 | NSC-636936 | CHALCONE, 4-NITRO- | A804866 | Tox21_202976 | 4-Nitrochalcone | 4-07-00-01666 (Beilstein Handbook Reference) | EINECS 209-276-9 | (2E)-3-(4-nit
Storage
Store at 2-8°C
Shipped In
Wet ice
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N159422-1g
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5g
N159422-5g
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25g
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2 재고 있음
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100g
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이 등급을 선택하는 이유

≥95%(HPLC) 최소한의 기준선 간섭이 필요한 민감한 크로마토그래피 및 분석 워크플로우용.

🌡

보관 및 배송

Store at 2-8°C Wet ice 출고. 정확한 사양은 로트별 COA를 확인하세요.

📋

품질 문서

SDS, COA, 데이터시트, 사양서를 다운로드할 수 있습니다. 로트별 COA는 로트 번호 조회를 통해 확인할 수 있습니다.

📚

문헌적 근거

크로마토그래피, 유기 합성 및 교차 커플링 반응 분야의 동료 심사 논문 0편에서 인용되었습니다.

개요

Mutagenic activity of 4-nitrochalcone on two strains of Salmonella typhimurium (TA98 and TA100) with and without rat liver microsomal and cytosolic enzymes has been tested


Application

4-Nitrochalcone was used in the synthesis of 2,3-dibromo-4-nitrochalcone.


사양

동의어
(E)-3-(4-Nitro-phenyl)-1-phenyl-propenone | NSC-27184 | DTXSID7049211 | MFCD00007382 | NSC636936 | NSC-636936 | CHALCONE, 4-NITRO- | A804866 | Tox21_202976 | 4-Nitrochalcone | 4-07-00-01666 (Beilstein Handbook Reference) | EINECS 209-276-9 | (2E)-3-(4-nit
사양 및 순도
≥95%(HPLC)
보관 조건
Store at 2-8°C
배송
Wet ice
이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.
순수함
≥95%(HPLC)
이름과 식별자
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488195522
정식 스마일
C1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]
IUPAC Name
(E)-3-(4-nitrophenyl)-1-phenylprop-2-en-1-one
InChIKey
WDZGGAFMGIOIQS-DHZHZOJOSA-N
INCHI
1S/C15H11NO3/c17-15(13-4-2-1-3-5-13)11-8-12-6-9-14(10-7-12)16(18)19/h1-11H/b11-8+
이성체 SMILES
C1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]
WGK 독일
2
RTECS
FL7075500
분자량
253.26
Beilstein
7(2)429
Reaxy-Rn
400543
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=400543&ln=

문서

📋 안전 데이터 시트(SDS)

위험성, 취급, 보관 및 규제 준수를 포괄하는 종합 문서.

<<<<<<< HEAD SDS 다운로드 → ======= SDS 다운로드 → >>>>>>> release248-p3

✅ 분석 성적서(COA)

로트별 품질 데이터. 로트 번호를 입력하여 정확한 COA를 확인하세요.

COA 조회 →

📊 데이터시트

제품 사양 및 응용 분야에 대한 빠른 참조 요약.

데이터시트 보기 →

🔬 사양서

이 등급의 전체 품질 특성 및 합격 기준.

사양서 보기 →

고급 데이터

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 Nitrobenzenes  Styrenes  Nitroaromatic compounds  Benzoyl derivatives  Aryl ketones  Enones  Acryloyl compounds  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Retrochalcone - Nitrobenzene - Nitroaromatic compound - Benzoyl - Styrene - Aryl ketone - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Ketone - C-nitro compound - Organic nitro compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organopnictogen 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 Not available
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.

16 results found

Lot NumberCertificate Type날짜항목
H2229679H2229679Certificate of AnalysisJun 09, 2026 N159422
H2125044H2125044Certificate of AnalysisJun 11, 2025 N159422
A2415462A2415462Certificate of AnalysisJan 23, 2024 N159422
A2415463A2415463Certificate of AnalysisJan 23, 2024 N159422
A2415464A2415464Certificate of AnalysisJan 23, 2024 N159422
A2415466A2415466Certificate of AnalysisJan 23, 2024 N159422
A2415472A2415472Certificate of AnalysisJan 23, 2024 N159422
D23261305D23261305Certificate of AnalysisMay 08, 2023 N159422
D23261306D23261306Certificate of AnalysisMay 08, 2023 N159422
D23261310D23261310Certificate of AnalysisMay 08, 2023 N159422
D23261314D23261314Certificate of AnalysisMay 08, 2023 N159422
D23261321D23261321Certificate of AnalysisMay 08, 2023 N159422
D2326954D2326954Certificate of AnalysisMay 08, 2023 N159422
D2326964D2326964Certificate of AnalysisMay 08, 2023 N159422
D2326984D2326984Certificate of AnalysisMay 08, 2023 N159422
B2311340B2311340Certificate of AnalysisFeb 20, 2023 N159422
화학 및 물리적 특성
녹는점(°C)163-167℃
분자량253.250 g/mol
XLogP32.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass253.074 Da
Monoisotopic Mass253.074 Da
Topological Polar Surface Area62.900 Ų
Heavy Atom Count19
Formal Charge0
Complexity345.000
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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