기본 정보
- CAS
19805-75-5- 표준 SMILES
CC1(C)C=C(C(N)=O)C(C)(C)N1- InChIKey
ACFYUJLIWIDSFM-UHFFFAOYSA-N- 분자식
- C9H16N2O
- 평균 분자량
- 168.24 g/mol
- 단동위원소 질량
- 168.12626314
개요
2,2,5,5-tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxamide is a pyrroline.
이름 및 식별자
- 우선 이름
- 1H-Pyrrole-3-carboxamide, 2,5-dihydro-2,2,5,5-tetramethyl-
- IUPAC
- 2,2,5,5-tetramethyl-1H-pyrrole-3-carboxamide
- 현지명
- 2,2,5,5-사메틸-3-피롤린-3-카르복스 아마이드
- 영어명
- 2,2,5,5-TETRAMETHYL-3-PYRROLINE-3-CARBOXAMIDE
- 분자식
- C9H16N2O
- 분자량
- 168.24
이름 및 동의어
19805-75-51H-Pyrrole-3-carboxamide, 2,5-dihydro-2,2,5,5-tetramethyl-2,5-Dihydro-2,2,5,5-tetramethyl-1H-pyrrole-3-carboxamide3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolineEINECS 243-331-8DTXSID80885099RefChem:439221DTXCID501024501243-331-82,2,5,5-Tetramethyl-3-pyrroline-3-carboxamide2,2,5,5-Tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxamide2,2,5,5-tetramethyl-1H-pyrrole-3-carboxamide
이름 더 보기
2,2,5,5-사메틸-3-피롤린-3-카르복스아마이드2,2,5,5-테트라메틸-3-피롤린-3-카르복사마이드2,2,5,5-테트라메틸-3-피롤린-3-카르복사미드2,2,5,5-Tetramethyl-3-pyrrolidinecarboxamide2,2,5,5-Tetramethyl-3-pyrroline-3-carboxamide 99%2,2,5,5-Tetramethyl-3-pyrroline-3-carboxamide,99%2,2,5,5-tetramethyl-1H-pyrrol-1-ium-3-carboxamide2,5-dihydro-2,2,5,5-tetramethyl-1h-pyrrole-3-carboxamid
MFCD00041846Maybridge3_0004403-Aminocarbonyl-2,2,5,5-tetramethyl-3-pyrrolineB6H8WY625DSCHEMBL5551221ACFYUJLIWIDSFM-UHFFFAOYSA-NCHEBI:1837061H-Pyrrole-3-carboxamide,2,5-dihydro-2,2,5,5-tetramethyl-
물성
구조 계산 물성
- XLogP
- -0.2
- 극성 표면적
- 55.1 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 251
물리화학적 성질
- 녹는점
- 180 · 180-182 °C(lit.)
- 끓는 점
- 297.19 °C · 297.19°C (rough estimate)
- 밀도
- 1.0404 · 1.0404 (rough estimate)
- 굴절률
- 1.4922 · 1.4922 (estimate)
- 저장 조건
- -20 °C · -20°C Freezer
- 용해도
- 디클로로메탄(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 색상
- 미색에서 밝은 오렌지색까지
- 수용성
- 물에 약간 용해됩니다.
- InChI
- 1S/C9H16N2O/c1-8(2)5-6(7(10)12)9(3,4)11-8/h5,11H,1-4H3,(H2,10,12)
- InChIKey
- ACFYUJLIWIDSFM-UHFFFAOYSA-N
- SMILES
- CC1(C)NC(C)(C)C(=C1)C(N)=O
- EPA
- 1 H-Pyrrole-3-carboxamide, · 1H-Pyrrole-3-carboxamide, 2,5-dihydro-2,2,5,5-tetramethyl- (19805-75-5)
화학적 성질
Off-White Crystalline Solid
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
용도 및 제조
General Manufacturing Information1H-Pyrrole-3-carboxamide, 2,5-dihydro-2,2,5,5-tetramethyl-: INACTIVE
응용 분야
용도2,2,5,5-TetraMethyl-3-pyrroline-3-carboxamide is a useful synthetic intermediate.
일반 설명2,2,5,5-Tetramethyl-3-pyrroline-3-carboxamide is a carboxamide of a hydrogenated pyrrole derivative. It is a sterically hindered amino compound having amino alkyl side chain. The antiarrhythmic activity of some of the derivatives of 2,2,5,5-tetramethyl-3-pyrroline-3-carboxamide have been evaluated.
공급사38 곳
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
VladaChem GmbH+49-7246-3082843 +86-18411632868 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…