기본 정보
- CAS
77469-62-6- 표준 SMILES
CC1CC(=O)NN=C1c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1- InChIKey
YFJQPSKUCIGNDT-UHFFFAOYSA-N- 분자식
- C18H18N4O3
- 평균 분자량
- 338.4 g/mol
- 단동위원소 질량
- 338.13789044
이름 및 식별자
- 우선 이름
- 6-(4-benzylamino-3-nitrophenyl)-5-methyl-4,5-dihydro-2H-pyridazin-3-one
- IUPAC
- 3-[4-(benzylamino)-3-nitrophenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one
- 영어명
- 4,5-Dihydro-5-methyl-6-[3-nitro-4-[(phenylmethyl)amino]phenyl]-3(2H)-pyridazinone
- 분자식
- C18H18N4O3
- 분자량
- 338.36
이름 및 동의어
6-(4-Benzylamino-3-nitrophenyl)-5-methyl-4,5-dihydro-2H-pyridazin-3-one4,5-Dihydro-5-methyl-6-[3-nitro-4-[(phenylmethyl)amino]phenyl]-3(2H)-pyridazinone4,5-Dihydro-5-methyl-6-(3-nitro-4-((phenylmethyl)amino)phenyl)-3(2H)-pyridazinoneRefChem:539376817-066-977469-62-66-(4-(Benzylamino)-3-nitrophenyl)-5-methyl-4,5-dihydropyridazin-3(2H)-one3-[4-(benzylamino)-3-nitrophenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one6-[4-(benzylamino)-3-nitrophenyl]-5-methyl-2,3,4,5-tetrahydropyridazin-3-one6-[4-(Benzylamino)-3-nitrophenyl]-5-methyl-4,5-dihydropyridazin-3(2H)-oneSCHEMBL1994538YFJQPSKUCIGNDT-UHFFFAOYSA-N
이름 더 보기
6-(4-benzylamino-3-PimobendanImpurity16-(4-BenzylaMino-3-nitrophenyl)-5-Methyl-2,3,4,56-(4-benzylaMino-3-nitrophenyl)-5-Methyl-2H-pyridazin-3-one6-(4-Benzylamino-3-nitrophenyl)-5-methyl-2,3,4,5-tetrahydrop...6-(4-BENZYLAMINO-3-NITROPHENYL)-5-METHYL -4 5-DIHYDRO-2H-PYRIDAZIN-3-ONE6-(4-Benzylamino-3-nitrophenyl)-5-methyl-2,3,4,5-tetrahydropyridazin-3-one
DTXSID001132886DB-0879475-methyl-6-(3-nitro-4-benzylamino-phenyl)-4,5-dihydro-2H-pyridazine-3-one6-(4-Benzylamino-3-nitro-phenyl)-5-methyl-4,5-dihydro-2H-pyridazin-3-one5-methyl-6-[3'-nitro-4'-benzylamino-phenyl]-4,5-dihydro-3(2H)-pyridazinone
데이터베이스 식별자
- CAS
77469-62-6- PubChem CID
- 11724680
- DTXSID
DTXSID001132886- EC Number
- 817-066-9
물성
구조 계산 물성
- XLogP
- 3.4
- 극성 표면적
- 99.3 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 525
물리화학적 성질
- 밀도
- 1.33 · 1.33
- 저장 조건
- 2 · 2-8°C
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationStatus: Cease Manufacture Update: 28-11-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21352
Hazard Classes and CategoriesAcute Tox. 4 (100%)
화학 및 산업
공급사15 곳
济南百隆化学有限公司[email protected] · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
河南誉康卓宁进出口有限公司13393721940 · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
常州昱仁化工有限公司0519-86802352 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466105 15377573527 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
常州英飒医药科技有限公司15151934985 · [email protected]
重庆卡兰医药有限公司[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
Henan Fengda Chemical Co., Ltd+86-371-86557731 +86-13613820652 · [email protected]
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