디부틸2-부텐디오에이트단독중합체
Dibutyl fumarate
기본 정보
- CAS
29014-71-9- 표준 SMILES
CCCCOC(=O)/C=C/C(=O)OCCCC- InChIKey
JBSLOWBPDRZSMB-BQYQJAHWSA-N- 분자식
- C12H20O4
- 평균 분자량
- 228.28 g/mol
개요
1,4-dibutyl but-2-enedioate has been reported in Festuca rubra with data available.
이름 및 식별자
- 우선 이름
- Dibutyl fumarate
- IUPAC
- dibutyl (E)-but-2-enedioate
- 현지명
- 디부틸2-부텐디오에이트단독중합체
- 영어명
- Dibutyl 2-butenedioate homopolymer
- 분자식
- C12H20O4
- 분자량
- 228.29
이름 및 동의어
DIBUTYL FUMARATE105-75-9Staflex DBFDi-n-butyl fumarateStafex DBFFumaric acid, dibutyl esterRC Comonomer DBFCQM31Z1NU9Dibutylester kyseliny fumaroveNSC-1402-Butenedioic acid (2E)-, 1,4-dibutyl esterRefChem:586519
이름 더 보기
디부틸2-부텐디오에이트단독중합체Dibutyl 2-butenedioate homopolymer
203-327-9Butyl fumaratedibutyl (E)-but-2-enedioate2-Butenedioic acid (E)-, dibutyl esterMFCD00065141dibutyl (2E)-but-2-enedioate(E)-dibutyl butenedioateWLN: 4OV1U1VO4-T
데이터베이스 식별자
- CAS
29014-71-9- ChEMBL
CHEMBL1771640、CHEMBL3247950- UNII
- CQM31Z1NU9
- EC Number
- 203-327-9
- Nikkaji
- J47.522J、J520.498D
물성
구조 계산 물성
- XLogP
- 2.7
- 극성 표면적
- 52.6 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 209
실험 및 물리화학적 성질
Chemical ClassesOther Classes -> Esters, Other
SpringerMaterials PropertiesFusion temperature
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical Description
Liquid
Clear nearly colorless liquid; [Acros Organics MSDS]
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 2.2% (7 of 315) of reports.
Warning
H317 (96.5%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P260, P261, P272, P273, P280, P302+P352, P319, P321, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 315 reports by companies from 18 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: 2-Butenedioic acid, (E)-, dibutyl ester
2-Butenedioic acid (2E)-, 1,4-dibutyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Butenedioic acid (2E)-, 1,4-dibutyl 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)
Status: Active Update: 18-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/2056
2-Butenedioic acid (2E)-, dibutyl ester: 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.
Hazards SummaryMay cause irritation; [Acros Organics MSDS]
Hazard Classes and CategoriesSkin Sens. 1 (96.5%)
안전 데이터
- 기존화학 물질
- 2001-3-1773
화학 및 산업
용도 및 제조
U.S. Production2023: 62,628 lb
Consumer UsesPlasticizer
Industry UsesPlasticizer
General Manufacturing Information
Plastics Product Manufacturing
2-Butenedioic acid (2E)-, 1,4-dibutyl ester: ACTIVE
관련 반응
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