N,N,N′-트리메틸에틸렌디아민

1,2-Ethanediamine, N1,N1,N2-trimethyl-

HCID 67338CAS 142-25-6

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CNCCN(C)C
InChIKey: HVOYZOQVDYHUPF-UHFFFAOYSA-N
분자식: C5H14N2
평균 분자량: 102.18 g/mol
단동위원소 질량: 102.11569845

이름 및 식별자

우선 이름: 1,2-Ethanediamine, N1,N1,N2-trimethyl-
IUPAC: N,N',N'-trimethylethane-1,2-diamine
현지명: N,N,N′-트리메틸에틸렌디아민
영어명: N,N,N'-Trimethylethylenediamine
분자식: C5H14N2
분자량: 102.18

이름 및 동의어

N,N,N'-Trimethylethylenediamine142-25-61,2-Ethanediamine, N,N,N'-trimethyl-1,2-Ethanediamine, N1,N1,N2-trimethyl-Dimethyl(2-(methylamino)ethyl)amineEINECS 205-529-2AI3-26671DTXSID8059714dimethyl[2-(methylamino)ethyl]amineRefChem:411909DTXCID4034607205-529-2

이름 더 보기

N,N,N′-트리메틸에틸렌디아민N,N,N'-트라이메틸에틸렌다이아민TrimethylethylenediamineenediamineN N N-TRIMETHYLETHYLENEDIAMINEN,N,N'-Trimethylethane-1,2-diamineN,N,N'-Trimethylethylenediamine (TMEDA)JACS-142-25-6N,N,N'-TRIMETHYLETHYN,N,N'-TrimethyldiamineCyclobutanecarboxylic aci

N1,N1,N2-Trimethylethane-1,2-diamine[2-(dimethylamino)ethyl](methyl)amineN,N',N'-trimethylethane-1,2-diamineN1,N1,N2-trimethyl-1,2-ethanediamineN,N,N-TrimethylethylenediamineMFCD00014874N,N,N'-TrimethylethylenediaminEthylenediamine, N,N,N'-trimethyl-

데이터베이스 식별자

CAS: 142-25-6
PubChem CID: 67338
DTXSID: DTXSID8059714
ChEMBL: CHEMBL3780444
UNII: AE94CUR3DE
EC Number: 205-529-2
Nikkaji: J25.731A

물성

구조 계산 물성

XLogP: -0.2
극성 표면적: 15.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 3
무거운 원자 수: 7
형식 전하: 0
복잡도: 35.1

물리화학적 성질

녹는점: -30.89 °C · -30.89°C (estimate)
끓는 점: 116 · 116-118 °C(lit.)
밀도: 0.786 g/mL · 0.786 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.419(lit.)
인화점: 49 °F · 49 °F
저장 조건: Inert atmosphere,Room Temperature
물리적 상태: 액체
산도 계수 (pKa): 10.34 · 10.34±0.10(Predicted)
색상: 무색의
BRN: 505989 · 505989
InChI: InChI=1S/C5H14N2/c1-6-4-5-7(2)3/h6H,4-5H2,1-3H3
InChIKey: HVOYZOQVDYHUPF-UHFFFAOYSA-N
SMILES: C(N(C)C)CNC
LogP: -0.2 · -0.200
EPA: 1 · 1,2-Ethanediamine, N,N,N'-trimethyl- (142-25-6)

화학적 성질

Clear colorless liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 49 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information1,2-Ethanediamine, N,N,N'-trimethyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesFlam. Liq. 2 (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 2733 3/PG 2
HS 번호: 29212900
risk_code: 11-34-37
hazard_code: F,C
safety_code: 16-26-36/37/39-45
포장분류: II
위험 등급: 3
기존화학 물질: KE-34518
F 고인화성물질: 34
Hazard Classifications: Flam. Liq. 2Skin Corr. 1B
스토리지 클래스: 3 - Flammable liquids

화학 및 산업

용도 및 제조

General Manufacturing Information1,2-Ethanediamine, N1,N1,N2-trimethyl-: ACTIVE

응용 분야 · 2건

용도N,N,N'-Trimethylethylenediamine is used as a precursor in the synthesis of a novel gemini surfactant viz. N,N-dimethyl-N-{2-[N'-methyl-N'-(3-sulfopropyl)-alkylammonium]ethyl}-1-alkylammonium bromides. It is also used as an amine component for in-situ formation of alpha-amino alkoxides. Further, it is involved in the synthesis of N,N'-dimethyl-N'-(2-hydroxy-aethyl)-aethylendiamin.

일반 설명N,N,N′-Trimethylethylenediamine is synthesized using laser-vaporization supersonic molecular beam. It has been studied using pulsed-field ionization zero electron kinetic energy.