기본 정보
- CAS
52821-24-6- 표준 SMILES
O=C1c2cccc3c(NCCCO)ccc(c23)C(=O)N1CCCO- InChIKey
WPQGAQRPOWJJGT-UHFFFAOYSA-N- 분자식
- C18H20N2O4
- 평균 분자량
- 328.4 g/mol
- 단동위원소 질량
- 328.14230712
이름 및 식별자
- 우선 이름
- 2-(3-Hydroxypropyl)-6-((3-hydroxypropyl)amino)-1H-benz(de)isoquinoline-1,3(2H)-dione
- IUPAC
- 2-(3-hydroxypropyl)-6-(3-hydroxypropylamino)benzo[de]isoquinoline-1,3-dione
- 영어명
- 2-(3-hydroxypropyl)-6-[(3-hydroxypropyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione
- 분자식
- C18H20N2O4
- 분자량
- 328.36
이름 및 동의어
52821-24-62-(3-hydroxypropyl)-6-[(3-hydroxypropyl)amino]-1h-benz[de]isoquinoline-1,3(2h)-dioneEINECS 258-203-7UNII-465RP3795J465RP3795JDAY-GLO MOHAWK YELLOW4-(3-Hydroxypropylamino)-naphthal(3-hydroxypropyl)imide1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-(3-hydroxypropyl)-6-[(3-hydroxypropyl)amino]-2-(3-Hydroxypropyl)-6-((3-hydroxypropyl)amino)-1H-benz(de)isoquinoline-1,3(2H)-dioneDTXSID50413001H-Benz(de)isoquinoline-1,3(2H)-dione, 2-(3-hydroxypropyl)-6-((3-hydroxypropyl)amino)-2-(3-HYDROXYPROPYL)-6-((3-HYDROXYPROPYL)AMINO)NAPHTHALIMIDE
이름 더 보기
1H-Benzdeisoquinoline-1,3(2H)-dione, 2-(3-hydroxypropyl)-6-(3-hydroxypropyl)amino-2-(3-Hydroxypropyl)-6-[(3-hydroxypropyl)amino]-1H-benzo[de]isoquinoline-1,3(2H)-dione
RefChem:84247DTXCID3021300258-203-72-(3-hydroxypropyl)-6-(3-hydroxypropylamino)benzo[de]isoquinoline-1,3-dione2-(3-Hydroxypropyl)-6-((3-hydroxypropyl)amino)-1H- benz(de)isoquinoline-1,3(2H)-dioneSCHEMBL1505152SCHEMBL30360198WPQGAQRPOWJJGT-UHFFFAOYSA-N
물성
구조 계산 물성
- XLogP
- 2
- 극성 표면적
- 89.9 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 470
물리화학적 성질
- 녹는점
- 210 · 210-211 °C(Solv: ethanol (64-17-5))
- 끓는 점
- 617.4 · 617.4±55.0 °C(Predicted)
- 밀도
- 1.378 · 1.378±0.06 g/cm3(Predicted)
- 증기압
- 0 Pa · 0Pa at 25℃
- 산도 계수 (pKa)
- 14.88 · 14.88±0.10(Predicted)
- 수용성
- 52.81 mg/L · 52.81mg/L at 25℃
- LogP
- 1.28 at · 1.28 at 25℃
- EPA
- 2 · 2-(3-Hydroxypropyl)-6-((3-hydroxypropyl)amino)-1H-benz(de)isoquinoline-1,3(2H)-dione (52821-24-6)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS ClassificationNot Classified
유해성 정보
Regulatory Information
Chemical: 1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-(3-hydroxypropyl)-6-[(3-hydroxypropyl)amino]-
REACH registered substance: 2-(3-hydroxypropyl)-6-[(3-hydroxypropyl)amino]-1H-benz[de]isoquinoline-1,3(2H)-dione (EC: 258-203-7)
1H-Benzdeisoquinoline-1,3(2H)-dione, 2-(3-hydroxypropyl)-6-(3-hydroxypropyl)amino-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesNot Classified
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-(3-hydroxypropyl)-6-[(3-hydroxypropyl)amino]-: ACTIVE
공급사5 곳
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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