이미벤코나졸

Imibenconazole

HCID 93483CAS 86598-92-7

기본 정보

표준 SMILES
Clc1ccc(CSC(Cn2cncn2)=Nc2ccc(Cl)cc2Cl)cc1
InChIKey
AGKSTYPVMZODRV-UHFFFAOYSA-N
분자식
C17H13Cl3N4S
평균 분자량
411.7 g/mol
단동위원소 질량
409.992651

이름 및 식별자

우선 이름
Imibenconazole
IUPAC
(4-chlorophenyl)methyl N-(2,4-dichlorophenyl)-2-(1,2,4-triazol-1-yl)ethanimidothioate
현지명
이미벤코나졸
영어명
IMIBENCONAZOLE
분자식
C17H13Cl3N4S
분자량
411.74

이름 및 동의어

Imibenconazole86598-92-7ManageImibenconazole [ISO]HF 6305HF 8505UNII-KQY333M0BEKQY333M0BE4-Chlorobenzyl N-2,4-dichlorophenyl-2-(1H-1,2,4-triazol-1-yl)thioacetamidateIMIBENCONAZOLE [MI]HF-6305HF-8505
이름 더 보기
이미벤코나졸4-클로로벤질 N-(2,4-다이클로로페닐)-2-(1H-1,2,4-트라이아졸-1-일)티오아 세티미드산hf8505hf6305imibenconazolIMIBENZONAZOLEenyl)methylesterIMIBENCONAZOLE STANDARDC14283600 Imibenconazole
1H-1,2,4-Triazole-1-ethanamidothioic acid, N-(2,4-dichlorophenyl)-, (4-chlorophenyl)methyl esterDTXSID7058204CHEBI:81767(4-chlorophenyl)methyl N-(2,4-dichlorophenyl)-1H-1,2,4-triazole-1-ethanimidothioateN-(2,4-Dichlorophenyl)-1H-1,2,4-triazole-1-ethanimidothioic acid (4-chlorophenyl)methyl ester1,2,4-TRIAZOL-1-YL-ISOTHIOACETIC ACID 2',4'-DICHLOROANILIDE S-P-CHLOROBENZYL ETHER4-CHLOROBENZYL (EZ)-N-(2,4-DICHLOROPHENYL)-2-(1H-1,2,4-TRIAZOL-1-YL)THIOACETAMIDATE4-chlorobenzyl N-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanimidothioate

데이터베이스 식별자

CAS
86598-92-7
PubChem CID
93483
DTXSID
DTXSID7058204
ChEMBL
CHEMBL3218922
ChEBI
CHEBI:81767
UNII
KQY333M0BE
EC Number
617-888-6
Nikkaji
J632.145C

물성

구조 계산 물성

XLogP
5.8
극성 표면적
68.4 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
6
무거운 원자 수
25

실험 및 물리화학적 성질

Kovats Retention Index3187

물리화학적 성질

녹는점
89.5 · 89.5-90°
끓는 점
567.4 · 567.4±60.0 °C(Predicted)
밀도
1.42 · 1.42±0.1 g/cm3(Predicted)
증기압
8.5 x · 8.5 x l0-8 Pa (25 °C)
인화점
4 ℃ · 4℃
저장 조건
0 · 0-6°C

안전 및 규제

GHS 분류

GHS Classification · 6건

Warning

H261 (100%): In contact with water releases flammable gas [Danger Substances and mixtures which in contact with water, emit flammable gases];H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin];H361 (100%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity];H371 (100%): May cause damage to organs [Warning Specific target organ toxicity, single exposure];H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure];H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P203, P231+P232, P260, P261, P264, P270, P272, P273, P280, P302+P352, P308+P316, P318, P319, P321, P333+P317, P362+P364, P370+P378, P391, P402+P404, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and Categories · 2건

Skin Sens. 1 (100%);Repr. 2 (100%);STOT SE 2 (100%);STOT RE 2 (100%);Aquatic Acute 1 (100%);Aquatic Chronic 1 (100%)

Acute toxicity (Oral) - Category 5;Serious eye damage/eye irritation - Category 2B;Skin sensitization - Category 1;Reproductive toxicity - Category 2;Specific target organ toxicity - Single exposure - Category 2 (nervous system);Specific target organ toxicity - Repeated exposure - Category 2 (blood system, spleen, urinary bladder, liver);Hazardous to the aquatic environment (Acute) - Category 1;Hazardous to the aquatic environment (Long-term) - Category 1

안전 데이터

wgk
2
rtecs
XZ4803030
ridadr
UN 1648 3 / PGII
독성
LD50 in male, female rats, male, female mice (mg/kg): 2800, 3000, >5000, >5000 orally; in male, female rats (mg/kg): >2000, >2000 dermally; in honey bees (mg/bee): >125 orally; LC50 (48 hr) in carp: 1.02 ppm; LC50 (6 hr) in water fleas: >102 ppm (Ogawa)
risk_code
11-20/21/22-36
hazard_code
F,Xn

화학 및 산업

응용 분야 · 1건

용도Imibenconazole is used to control scab, powdery mildew, Alternaria leaf spot, sooty blotch, fly speck and rust on apples, scab and rust on pears, scab and powdery mildew on fruits, and anthracnose and other diseases on roses and chrysanthemums.

공급사27 곳

江苏智芯廷科技有限公司18221391031 · [email protected]
广州佳途科技股份有限公司81960175 18933936954 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
上海艾梯西生物科技有限公司18721763493
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
추가 설명 · 1건

정의ChEBI: A member of the class of imidothioates that is the S-4-chlorobenzyl thioester of N-(2,4-dichlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanimidothioic acid. Used to control a range of fungal diseases affect ng fruit, vegetables, turf and ornamentals. It has a low mammalian toxicity and shows a moderate level of toxicity to fish, daphnia and earthworms but is relatively non-toxic to honey bees, birds and algae.

관련 반응

2건

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