모르팜콰트(ISO)1,1'-비스(3,5-디메틸모르폴리노카르보닐메틸)-4,4'-비피리딜륨이온
1,1'-Bis(2-(3,5-dimethyl-4-morpholinyl)-2-oxoethyl)-4,4'-bipyridinium
기본 정보
- CAS
7411-47-4- 표준 SMILES
CC1COCC(C)N1C(=O)C[n+]1ccc(-c2cc[n+](CC(=O)N3C(C)COCC3C)cc2)cc1- InChIKey
UBAQQOLXBOKEHR-UHFFFAOYSA-N- 분자식
- C26H36N4O4+2
- 평균 분자량
- 468.6 g/mol
- 단동위원소 질량
- 468.27365564
개요
pyridinium herbicide; like others of this type, reacts with atmospheric O(2) to form labile hydroperoxides, which in turn give off activated oxygen; RN given refers to dichloride; structure
이름 및 식별자
- 우선 이름
- 1,1'-Bis(2-(3,5-dimethyl-4-morpholinyl)-2-oxoethyl)-4,4'-bipyridinium
- IUPAC
- 1-(3,5-dimethylmorpholin-4-yl)-2-[4-[1-[2-(3,5-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethanone
- 현지명
- 모르팜콰트(ISO)1,1'-비스(3,5-디메틸모르폴리노카르보닐메틸)-4,4'-비피리딜륨이온
- 영어명
- morfamquat (ISO) 1,1'-bis(3,5-dimethylmorpholinocarbonylmethyl)-4,4'-bipyridilium ion
- 분자식
- C26H36N4O4+2
- 분자량
- 468.58844
이름 및 동의어
Morfamquat7411-47-41JCX24ZXMHDTXSID708640554,4'-Bipyridinium, 1,1'-bis(2-(3,5-dimethyl-4-morpholinyl)-2-oxoethyl)-1,1'-Bis(3,5-dimethylmorpholinocarbamylmethyl)-4,4'-bipyridilium dichlorideRefChem:409216DTXCID808126081,1'-Bis(2-(3,5-dimethyl-4-morpholinyl)-2-oxoethyl)-4,4'-bipyridinium1-(3,5-dimethylmorpholin-4-yl)-2-(4-(1-(2-(3,5-dimethylmorpholin-4-yl)-2-oxo-ethyl)pyridin-1-ium-4-yl)pyridin-1-ium-1-yl)ethanone;dichlorideMorfamquat [ISO]UNII-1JCX24ZXMH
이름 더 보기
모르팜콰트(ISO)1,1'-비스(3,5-디메틸모르폴리노카르보닐메틸)-4,4'-비피리딜륨이온PP-745Morfoxonemorfamquat (ISO) 1,1'-bis(3,5-dimethylmorpholinocarbonylmethyl)-4,4'-bipyridilium ion
1-(3,5-dimethylmorpholin-4-yl)-2-[4-[1-[2-(3,5-dimethylmorpholin-4-yl)-2-oxoethyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethanone1,1'-bis(3,5-dimethylmorpholinocarbonylmethyl)-4,4'-bipyridiniumMORFAMQUAT IONMORFAMQUAT CATION1-(3,5-dimethylmorpholin-4-yl)-2-[4-[1-[2-(3,5-dimethylmorpholin-4-yl)-2-oxo-ethyl]pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]ethanoneSCHEMBL132886UBAQQOLXBOKEHR-UHFFFAOYSA-NC26H36N4O4+2
물성
구조 계산 물성
- XLogP
- 1.9
- 극성 표면적
- 66.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 34
- 형식 전하
- 2
- 복잡도
- 612
물리화학적 성질
- EPA
- Morfamquat (7411-47-4)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Warning
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
유해성 정보
Hazard Classes and Categories
Acute toxicity - category 4
Acute Tox. 4 *
안전 데이터
- risk_code
- 22-36/37/38-52/53
- hazard_code
- Xn
- safety_code
- 22-36-61
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