기본 정보
- CAS
57116-45-7- 표준 SMILES
O=C(CCN1CC1)OCC(CO)(COC(=O)CCN1CC1)COC(=O)CCN1CC1- InChIKey
KAPCRJOPWXUMSQ-UHFFFAOYSA-N- 분자식
- C20H33N3O7
- 평균 분자량
- 427.5 g/mol
- 단동위원소 질량
- 427.2318504
개요
RN and structure given in first source
이름 및 식별자
- 우선 이름
- Pentaerythritol tris(3-(1-aziridinyl)propionate)
- IUPAC
- [2,2-bis[3-(aziridin-1-yl)propanoyloxymethyl]-3-hydroxypropyl] 3-(aziridin-1-yl)propanoate
- 영어명
- Pentaerythritol tris[3-(1-aziridinyl)propionate]
- 분자식
- C20H33N3O7
- 분자량
- 427.49
이름 및 동의어
57116-45-7Pentaerythritol tris(3-(1-aziridinyl)propionate)Xama 7Pentaerythritol tris[3-(1-aziridinyl)propionate]XAMA-7RefChem:195095260-568-2TAZOEINECS 260-568-2MFCD01757346DTXSID6044696Pentaerythritol tris(3-aziridin-1-ylpropionate)
이름 더 보기
Aziridinepropanoicacidxama7APA-1POLY X7TAZO, XAMA 73-(1-aziridinyl)propanoate1-AZIDIRIDINEPROPANOIC ACIDmethyl)-1,3-propanediylester
Pentaerythritol-tris-(beta-(N-aziridinyl)propionate)3-(aziridin-1-yl)propanoatePentaerythritol, tris(beta-(N-aziridinyl)propionate) ester3-{[3-(aziridin-1-yl)propanoyl]oxy}-2-({[3-(aziridin-1-yl)propanoyl]oxy}methyl)-2-(hydroxymethyl)propyl 3-(aziridin-1-yl)propanoateTox21_302250[2,2-bis[3-(aziridin-1-yl)propanoyloxymethyl]-3-hydroxypropyl] 3-(aziridin-1-yl)propanoateCAS-57116-45-7CS-0158335
데이터베이스 식별자
- CAS
57116-45-7- PubChem CID
물성
구조 계산 물성
- XLogP
- -1.4
- 극성 표면적
- 108 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 19
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 524
실험 및 물리화학적 성질
Physical DescriptionLiquid
물리화학적 성질
- 끓는 점
- 542.3 · 542.3±50.0 °C(Predicted)
- 밀도
- 1.158 g/mL · 1.158 g/mL at 25 °C(lit.)
- 굴절률
- 20 · n20/D 1.496(lit.)
- 인화점
- 113 °C · 113 °C
- 저장 조건
- 2 · 2-8°C
- 산도 계수 (pKa)
- 13.67 · 13.67±0.10(Predicted)
- EPA
- 3 · Pentaerythritol tris[3-(1-aziridinyl)propionate] (57116-45-7)
화학적 성질
d 1.18-1.20, >1 Pas
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 6.7% (5 of 75) of reports.
Danger
H317 (40%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P203, P261, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P318, P319, P321, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 75 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: 1-Aziridinepropanoic acid, 2-[[3-(1-aziridinyl)-1-oxopropoxy]methyl]-2-(hydroxymethyl)-1,3-propanediyl ester
1-Aziridinepropanoic acid, 1,1'-[2-[[3-(1-aziridinyl)-1-oxopropoxy]methyl]-2-(hydroxymethyl)-1,3-propanediyl] ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Aziridinepropanoic acid, 1,1'-[2-[[3-(1-aziridinyl)-1-oxopropoxy]methyl]-2-(hydroxymethyl)-1,3-propanediyl] ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
1-Aziridinepropanoic acid, 2-3-(1-aziridinyl)-1-oxopropoxymethyl-2-(hydroxymethyl)-1,3-propanediyl ester: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Sens. 1 (40%)
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- CM8492750
- risk_code
- 36-40
- hazard_code
- Xi
- safety_code
- 26-27-36-45
화학 및 산업
용도 및 제조
U.S. Production2023: 50,000 - <250,000 lb
Consumer UsesHardener
Industry UsesHardener
General Manufacturing Information
All Other Basic Inorganic Chemical Manufacturing
1-Aziridinepropanoic acid, 1,1'-[2-[[3-(1-aziridinyl)-1-oxopropoxy]methyl]-2-(hydroxymethyl)-1,3-propanediyl] ester: ACTIVE
응용 분야
용도trifunctional aziridine reagent very reactive for active hydrogen groups
공급사100 곳
上海利卡斯实业有限公司19821976800 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
广州纳珑化工有限公司13192879270; 13192879270 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
河北创海生物科技有限公司
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…