기본 정보
- CAS
144550-06-1- 표준 SMILES
COC(=O)c1ccc(I)cc1S(=O)(=O)NC(=O)Nc1nc(C)nc(OC)n1- InChIKey
VWGAYSCWLXQJBQ-UHFFFAOYSA-N- 분자식
- C14H14IN5O6S
- 평균 분자량
- 507.26 g/mol
- 단동위원소 질량
- 506.97095217
이름 및 식별자
- 우선 이름
- Methyl 4-iodo-2-(3-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)ureidosulfonyl)benzoate
- IUPAC
- methyl 4-iodo-2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoate
- 영어명
- Iodosulfuron-methyl
- 분자식
- C14H14IN5O6S
- 분자량
- 507.26
이름 및 동의어
144550-06-1EC 429-890-2methyl 4-iodo-2-(3-(4-methoxy-6-methyl-1,3,5-triazine-2-yl)ureidosulfonyl)benzoateRefChem:816483429-890-2Iodosulfuron-methylmethyl 4-iodo-2-(N-(4-methoxy-6-methyl-1,3,5-triazin-2-ylcarbamoyl)sulfamoyl)benzoateIodosulfuron Methyl EsterMethyl 4-iodo-2-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoylsulfamoyl]benzoatemethyl 4-iodo-2-(N-((4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl)sulfamoyl)benzoateMethyl 4-iodo-2-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}benzoateBenzoic acid,4-iodo-2-[[[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]amino]sulfonyl]-, methyl ester
이름 더 보기
Iodosulfuron-methyl StandardBenzoic acid, 4-iodo-2-[[[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]amino]sulfonyl]-, methyl ester
C14H14IN5O6Siodosulfuron-methyl [ISO]6L4PMK9E4HSCHEMBL733383CHEMBL3580410SCHEMBL29508665SCHEMBL31392854DTXSID101020557
데이터베이스 식별자
- CAS
144550-06-1- PubChem CID
- 11027582
- DTXSID
DTXSID101020557- ChEMBL
CHEMBL3580410- UNII
- 6L4PMK9E4H
- EC Number
- 429-890-2
- Nikkaji
- J1.945.807E
물성
구조 계산 물성
- XLogP
- 2.2
- 극성 표면적
- 158 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 27
- 형식 전하
- 0
- 복잡도
- 644
실험 및 물리화학적 성질
Pesticides
Herbicides
Environmental transformation -> Pesticides (parent, predecessor)
Collision Cross Section196.1 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID2034673]
물리화학적 성질
- 녹는점
- 165 ℃ · approximate 165℃
안전 및 규제
GHS 분류
GHS Classification
Warning
H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
Warning
H252 (33.3%): Self-heating in large quantities; may catch fire [Warning Self-heating substances and mixtures]
P235, P273, P280, P391, P407, P410, P413, P420, and P501 (click each P-code to see the statement)
유해성 정보
Regulatory InformationStatus: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/9722
Hazard Classes and Categories
Self-heat. 2 (33.3%)
Hazardous to the aquatic environment (acute) - category 1
Aquatic Acute 1
안전 데이터
- 신호 어
- Warning
- 유해·위험 문구
- 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H410
화학 및 산업
용도 및 제조
Use Classification
Herbicides
Environmental transformation -> Pesticides (parent, predecessor)
공급사4 곳
Struchem CO.,LTD86-512-63009836 · [email protected]
成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
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