기본 정보
- CAS
95977-29-0- 표준 SMILES
C[C@@H](Oc1ccc(Oc2ncc(C(F)(F)F)cc2Cl)cc1)C(=O)O- InChIKey
GOCUAJYOYBLQRH-MRVPVSSYSA-N- 분자식
- C15H11ClF3NO4
- 평균 분자량
- 361.7 g/mol
- 단동위원소 질량
- 361.03287
개요
Haloxyfop-P is a 2-(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid that has R configuration. It is the most active enantiomer of the (racemic) herbicide haloxyfop and is used (particularly as the corresponding methyl and ethoxyethyl ester proherbicides (haloxyfop-P-methyl and haloxyfop-P-etotyl, respectively) to control annual and perrenial grasses in a variety of crops. It has a role as an agrochemical, a phenoxy herbicide and an EC 6.4.1.2 (acetyl-CoA carboxylase) inhibitor. It is a conjugate acid of a haloxyfop-P(1-). It is an enantiomer of a (S)-haloxyfop.
이름 및 식별자
- 우선 이름
- Haloxyfop-P
- IUPAC
- (2R)-2-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]propanoic acid
- 영어명
- Haloxyfop-P
- 분자식
- C15H11ClF3NO4
- 분자량
- 361.7
이름 및 동의어
Haloxyfop-P95977-29-0(+)-haloxyfopHaloxyfop-P [ISO]R-haloxyfop-acid(R)-haloxyfop(R)-haloxyfop-acid(2r)-2-(4-{[3-Chloro-5-(Trifluoromethyl)pyridin-2-Yl]oxy}phenoxy)propanoic AcidUNII-I57833604I(R)-(+)-HALOXYFOPI57833604ICHEBI:47454
이름 더 보기
(R)-2-[4-[[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]propanoic acidHaloxyfop-R-methyl ECHaloxyfop-R(free acid)Haloxyfop-P (free acid)Haloxyfop-P in Methanolhaloxyfop-P Solution, 100ppmhaloxyfop-P Solution, 1000ppm
DTXSID90904725(2R)-2-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]propanoic acidPropanoic acid, 2-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]-, (2R)-Haloxyfop-R(r)-2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridyloxy]phenoxy}propionic acid(2R)-2-(4-((3-chloro-5-(trifluoromethyl)-2-pyridinyl)oxy)phenoxy)propanoic acid(2R)-2-(4-((3-chloro-5-(trifluoromethyl)pyridin-2-yl)oxy)phenoxy)propanoic acid(R)-2-(4-(3-chloro-5-(trifluoromethyl)-2-pyridyloxy)phenoxy)propionic acid
데이터베이스 식별자
- CAS
물성
구조 계산 물성
- XLogP
- 4.2
- 극성 표면적
- 68.7 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 429
실험 및 물리화학적 성질
DrugsPharmaceuticals -> Listed in ZINC15
Pesticides
Herbicides
Active substance -> EU Pesticides database: Not approved
Environmental transformation -> Pesticides (parent, predecessor)
Endocrine DisruptorsPotential endocrine disrupting compound
물리화학적 성질
- 끓는 점
- 420.3 · 420.3±45.0 °C(Predicted)
- 밀도
- 1.442 · 1.442
- 저장 조건
- 2 · 2-8°C
- 용해도
- 디클로로메탄,에틸아세테이트,에테르에 용해됨
- 산도 계수 (pKa)
- 3.12 · 3.12±0.10(Predicted)
- 물리적 상태
- solid
- 색상
- 하얀색
- BRN
- 8571970 · 8571970
- InChI
- 1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)/t8-/m1/s1
- InChIKey
- GOCUAJYOYBLQRH-MRVPVSSYSA-N
- SMILES
- C[C@@H](Oc1ccc(Oc2ncc(cc2Cl)C(F)(F)F)cc1)C(O)=O
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Commission Implementing Regulation (EU) No 540/2011 (amended)
2010/86/EU, Reg. (EU) 2015/2233, Reg. (EU) 2020/1643, Reg. (EU) 2022/801, Reg. (EU) No 2018/670, Reg. (EU) No 540/2011
Hazard Classes and CategoriesAcute Tox. 4 (97.5%)
안전 데이터
- wgk
- 3
- risk_code
- 22-52/53
- hazard_code
- Xn
- Hazard Classifications
- Acute Tox. 3 OralAquatic Acute 1Aquatic Chronic 1
- 스토리지 클래스
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
화학 및 산업
용도 및 제조
Use ClassificationEnvironmental transformation -> Pesticides (parent, predecessor)
응용 분야
용도Haloxyfop-P is a herbicide for controlling weeds in cassia fields. A pesticide residue in vegetables.
공급사39 곳
湖北科麦迪化工有限公司18372743325
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
湖北长耀生物科技有限公司17683887209 17683887209 · [email protected]
上海澜克医药科技有限公司021-52216295 lankepharma
上海艾梯西生物科技有限公司18721763493
武汉贝乐叶生物医药科技有限公司15871353653 18086118076 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
武汉壹加壹生物科技有限公司027-027-16602739303 16602739303 · [email protected]
Xiamen Eagle Chemical Limited Corporation+86-18900207489 · [email protected]
LUYUNJIA CHEMISTRY XIAMEN LIMITED
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