2-(2-Aminoethyl)-1-methylpyrrolidine
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기본 정보
- CAS
51387-90-7- 표준 SMILES
CN1CCCC1CCN- InChIKey
PNHGJPJOMCXSKN-UHFFFAOYSA-N- 분자식
- C7H16N2
- 평균 분자량
- 128.22 g/mol
- 단동위원소 질량
- 128.13134851
개요
1-Methylpyrrolidine-2-ethylamine is a pyrrolidine substituted by a methyl group at position 1 and bearing an ethylamine at position 2. It is functionally related to an ethylamine.
이름 및 식별자
- 우선 이름
- 2-(2-Aminoethyl)-1-methylpyrrolidine
- IUPAC
- 2-(1-methylpyrrolidin-2-yl)ethanamine
- 영어명
- 2-(2-Aminoethyl)-1-methylpyrrolidine
- 분자식
- C7H16N2
- 분자량
- 128.22
이름 및 동의어
2-(2-Aminoethyl)-1-methylpyrrolidine51387-90-71-Methylpyrrolidine-2-ethylamineDTXSID4012913972-[2-Aminoethyl]-1-methylpyrrolidineRefChem:434680DTXCID40892840257-169-02-(1-methylpyrrolidin-2-yl)ethanamine2-Pyrrolidineethanamine, 1-methyl-MFCD000031752-(1-Methylpyrrolidin-2-Yl)Ethan-1-Amine
이름 더 보기
2-(2-Aminoethyl)-1-methyl2-(2-Aminoethyl)-1-methylpyN-Methyl-2-(2-aMinoethyl)pyr2-AMinoethyl-1-MethylpyrrolidineN-Methyl-2-Pyrrolidineethanamine1-methyl-2-(aminoethyl)pyrrolidine
2-(1-methylpyrrolidin-2-yl)ethylamine2-(2'-Aminoethyl)-1-N-methylpyrrolidine2-(1-Methyl-2-pyrrolidinyl)ethylamine1-Methylpyrrolidine-2-ethanamine(R)-1-METHYL-2-PYRROLIDINEETHANAMINE1-METHYL-2-(2-AMINOETHYL)PYRROLIDINE1-Methyl-2-pyrrolidineethanamineN-Methyl-2-(2-aminoethyl)pyrrolidine
데이터베이스 식별자
- CAS
51387-90-7- PubChem CID
- 98388
- DTXSID
DTXSID401291397- ChEBI
CHEBI:234484- EC Number
- 257-169-0
- Nikkaji
- J236.383F
물성
구조 계산 물성보충 중
- XLogP
- 0.2
- 극성 표면적
- 29.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 9
- 형식 전하
- 0
- 복잡도
- 83
물리화학적 성질
- 끓는 점
- 152.7 · 152.7±8.0 °C(Predicted)
- 밀도
- 0.885 g/mL · 0.885 g/mL at 25 °C (lit.)
- 굴절률
- 20 · n20/D 1.4684(lit.)
- 인화점
- 149 °F · 149 °F
- 저장 조건
- Keep in dark place,Inert atmosphere,Room temperature
- 용해도
- 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
- 산도 계수 (pKa)
- 10.34 · 10.34±0.40(Predicted)
- 물리적 상태
- 가루
- 색상
- 라이트 베이지부터 라이트 브라운까지
- InChI
- InChI=1S/C7H16N2/c1-9-6-2-3-7(9)4-5-8/h7H,2-6,8H2,1H3
- InChIKey
- PNHGJPJOMCXSKN-UHFFFAOYSA-N
- SMILES
- N1(C)CCCC1CCN
화학적 성질
Clear colorless to pale yellow liquid
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H302 (97.7%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+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 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (97.7%)
안전 데이터
- wgk
- 2
- ridadr
- 2735
- HS 번호
- 29339900
- risk_code
- 22-37/38-41
- hazard_code
- Xn
- safety_code
- 26-39
- 포장분류
- III
- 위험 등급
- 8
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 10 - Combustible liquids
화학 및 산업
응용 분야
용도2-(2-Aminoethyl)-1-methylpyrrolidine is used as an electrochemiluminescence probe within microfluidic chip for ECL detection. 2-(2-Aminoethyl)-1-methylpyrrolidine is also used in chemical microarrays to identify ligands that bind pathogenic cells.
일반 설명2-(2-Aminoethyl)-1-methylpyrrolidine labelling acts as probe within microfluidic chip for electrochemiluminescence detection. It acts as electrogenerated chemiluminescence derivatization reagent for carboxylic acid in HPLC.
상·하류 제품 정보
상류 원료
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