기본 정보
- CAS
495-73-8- 표준 SMILES
O=Nc1ccc(NNC(=O)c2ccccc2)cc1- InChIKey
MQIVNMHALJNFMG-UHFFFAOYSA-N- 분자식
- C13H11N3O2
- 평균 분자량
- 241.24 g/mol
- 단동위원소 질량
- 241.0851266
개요
Benquinox is a member of benzamides.
이름 및 식별자
- 우선 이름
- Benquinox
- IUPAC
- N'-(4-nitrosophenyl)benzohydrazide
- 현지명
- 벤퀴녹스
- 영어명
- p-benzoquinone 1-benzoylhydrazon-4-oxime
- 분자식
- C13H11N3O2
- 분자량
- 241.25
이름 및 동의어
BenquinoxCerenox495-73-8TserenoxLerenoxBenchinoxCEREDONBenquinox [ISO]BenguinoxCerelineTillantoxCereden
이름 더 보기
벤퀴녹스QBHCOBHB-15080MQIVNMHALJNFMG-UHFFFAOYSA-NN'-(4-nitrosophenyl)benzohydrazidep-benzoquinone 1-benzoylhydrazon-4-oxime
Quinone oxime benzoylhydrazoneBayer 15080Caswell No. 075Bp-Benzoquinone oxime benzoylhydrazoneChinonoxime-benzoylhydrazoneHSDB 2759Chinonoxim-benzoylhydrazon1,4-Benzoquinone N'-benzoylhydrazone oxime
데이터베이스 식별자
- CAS
495-73-8- PubChem CID
- 10320
- DTXSID
DTXSID2041624- ChEBI
CHEBI:82066- UNII
- XVO47UK8V8
- EC Number
- 207-807-9
- Nikkaji
- J6.082H
물성
구조 계산 물성
- XLogP
- 2.4
- 극성 표면적
- 70.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 282
실험 및 물리화학적 성질
PesticidesPesticides -> Fungicides
Color/FormYELLOW-BROWN POWDER; YELLOW CRYSTALS FROM ETHANOL
Solubility
IN WATER 5 PPM; SOL IN ORGANIC SOLVENTS
SOL IN FORMAMIDE
Physical DescriptionYellow or yellow-brown solid; [HSDB]
Stability/Shelf LifeNON-VOLATILE
Other Experimental PropertiesPOWDER DECOMP @ 195 °C; CRYSTALS DECOMP @ 207 °C
물리화학적 성질
- 끓는 점
- 384.02 °C · 384.02°C (rough estimate)
- 밀도
- 1.2057 · 1.2057 (rough estimate)
- 굴절률
- 1.56 · 1.5600 (estimate)
- 용해도
- soluble in No data available
- 수용성
- 5 mg/L · 5mg/L(온도는 명시되지 않음)
- EPA
- Benquinox (495-73-8)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H301: Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P280, P301+P316, P302+P352, P317, P321, P330, P362+P364, P405, and P501 (click each P-code to see the statement)
Danger
H301: Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P280, P301+P316, P302+P352, P317, P321, P330, P362+P364, P405, and P501 (click each P-code to see the statement)
유해성 정보
DOT Hazard Classification
Benquinox
Marine pollutant
Hazard Classes and Categories
Acute toxicity (ingestion) - category 3
Acute Tox. 3 *
안전 데이터
- ridadr
- 2588
- 독성
- LD50 oral in rat: 100mg/kg
- risk_code
- 21-25
- hazard_code
- T
- safety_code
- 36/37-45
- 포장분류
- III
- 위험 등급
- 6.1(b)
- 유해 물질 데이터
- 495-73-8(Hazardous Substances Data)
화학 및 산업
용도 및 제조
Uses
Used for protection of seeds and seedlings from soil fungi; Developed by Bayer in 1951 and product discontinued by Bayer sometime before 1983; [HSDB]
Farming (Pesticides) [Category: Industry]
FUNGICIDE
Methods of Manufacturing...BY INTERACTION OF FRESHLY PREPARED SOLID NITROSOPHENOL WITH ACID AQ SOLN OF BENZOYLHYDRAZINE; PRODUCT IS USED WITHOUT FURTHER PURIFICATION (PETERSEN S ET AL; AGNEW CHEM 76: 217 (1955)).
Formulations/PreparationsCEREDON SPECIAL, CERELINE, TILLANTOX, WITH PHENYLMERCURIC CHLORIDE; CEREDON T, WITH THIRAM; RHIZOCTOL SLURRY, RHIZOCTOL COMBI, WITH METHYLARSINIC SULFIDE.
General Manufacturing Information
DEVELOPED IN 1951 BY BAYER & INTRODUCED IN 1955 AS FUNGICIDE: (FROHBERGER PE; PHYTOPATH Z 27: 427 (1956); FRENCH PATENT 1,093,364; US PATENT 2,785,101; DEUTSCHE AUSLEGESCHRIFT PATENT 1,001,854.
PRODUCT DISCONTINUED BY BAYER AG.
FOR PROTECTION OF SEED AND SEEDLINGS FROM SOIL FUNGI. NOT SUITABLE FOR USE AGAINST SEED-BORNE DISEASES OF CEREALS.
응용 분야
용도p-benzoquinone 1-benzoylhydrazon-4-oxime is used in the synthesis of P-glycoprotein inhibitors. It is also a compound displaying antifungal and antibacterial activity.
공급사8 곳
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD
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