기본 정보
- CAS
135397-30-7- 표준 SMILES
COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2c(C(=O)O)c(Cl)nn2C)n1- InChIKey
LXKOADMMGWXPJQ-UHFFFAOYSA-N- 분자식
- C12H13ClN6O7S
- 평균 분자량
- 420.79 g/mol
- 단동위원소 질량
- 420.0254956
이름 및 식별자
- 우선 이름
- Halosulfuron
- IUPAC
- 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylic acid
- 영어명
- 3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl- pyrazole-4-carboxylic acid
- 분자식
- C12H13ClN6O7S
- 분자량
- 420.79
이름 및 동의어
Halosulfuron135397-30-7Halosulfuron [ISO:BSI]UNII-8WU8U5S0UR8WU8U5S0URHALOSULFURON [ISO]DTXSID30749471H-Pyrazole-4-carboxylic acid, 3-chloro-5-(((((4,6-dimethoxy-2-pyrimidinyl)amino)carbonyl)amino)sulfonyl)-1-methyl-1H-Pyrazole-4-carboxylic acid, 3-chloro-5-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-1-methyl-3-chloro-5-(4,6-dimethoxypyrimidin-2-ylcarbamoylsulfamoyl)-1-methylpyrazole-4-carboxylic acid3-CHLORO-5-(((((4,6-DIMETHOXY-2-PYRIMIDINYL)AMINO)CARBONYL)AMINO)SULFONYL)-1-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACIDRefChem:145118
이름 더 보기
3-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl- pyrazole-4-carboxylic acid
DTXCID40343183-chloro-5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methylpyrazole-4-carboxylic acidHalosulfuron (free acid)SCHEMBL66216orb2653212CHEMBL2251588KFA39730EX-A11508
데이터베이스 식별자
- CAS
135397-30-7- PubChem CID
- 86414
- DTXSID
DTXSID3074947- ChEMBL
CHEMBL2251588- UNII
- 8WU8U5S0UR
- Nikkaji
- J848.785E
물성
구조 계산 물성
- XLogP
- 1
- 극성 표면적
- 183 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 27
- 형식 전하
- 0
- 복잡도
- 649
실험 및 물리화학적 성질
PesticidesPesticide (Halosulfuron) -> USDA PDB
물리화학적 성질
- 밀도
- 1.79 · 1.79±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 0.93 · 0.93±0.50(Predicted)
- EPA
- 1 H-Pyrazole-4-carboxylic · 1H-Pyrazole-4-carboxylic acid, 3-chloro-5-[[[[(4,6-dimethoxy-2-pyrimidinyl)amino]carbonyl]amino]sulfonyl]-1-methyl- (135397-30-7)
화학 및 산업
응용 분야
용도Halosulfuron is a new generation pesticide primarily applied to crop fields and is effective in weed control.
공급사9 곳
沈阳中申泽康生物医学技术研究有限公司024-88590548 18698872706 · [email protected]
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
上海艾梯西生物科技有限公司18721763493 · [email protected]
NANJING YINGWEN BIOTECHNOLOGY CO LTD+8613382787392 · [email protected]
玺标（上海）科技有限公司18512111473 18512111473 · [email protected]
淄博航宇生物科技发展有限公司13053322091 13053322091 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
济南思考化学有限公司0531-0000 · [email protected]
上海杰股生物科技有限公司021-51698675 · [email protected]
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