기본 정보
- CAS
111812-58-9- 표준 SMILES
Cc1nn(C)c(Oc2ccccc2)c1C=NOCc1ccc(C(=O)OC(C)(C)C)cc1- InChIKey
YYJNOYZRYGDPNH-UHFFFAOYSA-N- 분자식
- C24H27N3O4
- 평균 분자량
- 421.5 g/mol
- 단동위원소 질량
- 421.20015634
개요
See also: Fenpyroximate (annotation moved to).
이름 및 식별자
- 우선 이름
- Benzoic acid, 4-(1,3-dimethyl-5-phenoxy-1H-pyrazol-4-yl)methyleneaminooxymethyl-, 1,1-dimethylethyl ester
- IUPAC
- tert-butyl 4-[[(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoate
- 영어명
- Fenpyroximate
- 분자식
- C24H27N3O4
- 분자량
- 421.49
이름 및 동의어
Benzoic acid, 4-[[[[(1,3-dimethyl-5-phenoxy-1H-pyrazol-4-yl)methylene]amino]oxy]methyl]-, 1,1-dimethylethyl esterBenzoic acid, 4-(((((1,3-dimethyl-5-phenoxy-1H-pyrazol-4-yl)methylene)amino)oxy)methyl)-, 1,1-dimethylethyl esterRefChem:565869Benzoic acid, 4-(1,3-dimethyl-5-phenoxy-1H-pyrazol-4-yl)methyleneaminooxymethyl-, 1,1-dimethylethyl esterFenpyroximate (Z,E)111812-58-9DTXSID2032550tert-butyl 4-[[(1,3-dimethyl-5-phenoxypyrazol-4-yl)methylideneamino]oxymethyl]benzoateC24H27N3O4Z)-FENPYROXIMATE STANDARDFenpyroximate (CRM)SCHEMBL678539
이름 더 보기
KIRONORTUSPAMANRINDANITRONDANITORONFenpyroximatFenpyroximate(Z,E)-FenpyroximateDodemorph Impurity 4
orb1306919orb3025549AKOS030254854DB-041008NS00127091Tert-butyl 4-[(1,3-dimethyl-5-phenoxypyrazol-4-yl)methyleneaminooxymethyl]benzoatetert-butyl 4-[[(1,3-dimethyl-5-phenoxy-pyrazol-4-yl)methyleneamino]oxymethyl]benzoatetert-butyl 4-[({[(1,3-dimethyl-5-phenoxy-1H-pyrazol-4-yl)methylidene]amino}oxy)methyl]benzoate
물성
구조 계산 물성
- XLogP
- 4.9
- 극성 표면적
- 74.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 31
- 형식 전하
- 0
- 복잡도
- 592
실험 및 물리화학적 성질
Collision Cross Section207.4 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID2032550]
물리화학적 성질
- 녹는점
- 99 · 99-102°C
- 끓는 점
- 546.2 · 546.2±60.0 °C(Predicted)
- 밀도
- 1.245 · 1.245
- 인화점
- 100 °C · 100 °C
- 저장 조건
- 0 · 0-6°C
- 용해도
- 아세톤, 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 1.53 · 1.53±0.10(Predicted)
- 색상
- 흰색에서 연한 노란색
화학적 성질
White Solid
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory Information
Benzoic acid, 4-(1,3-dimethyl-5-phenoxy-1H-pyrazol-4-yl)methyleneaminooxymethyl-, 1,1-dimethylethyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
안전 데이터
- ridadr
- UN 3077 9/PG 3
- HS 번호
- 29331990
- risk_code
- 20-50/53
- hazard_code
- Xn,N
- safety_code
- 22-60-61
화학 및 산업
응용 분야
용도A pesticide residue in crops. The agricultural active ingredient is a pesticide selected from the group consisting of herbicides, insecticides, acaricides, fungicides, nematocides, and bactericides.
공급사77 곳
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