1-(2-아미노에틸)이미다졸리딘-2-온

1-(2-아미노에틸)이미다졸리딘-2-온 · BUTTPARK 52\06-90 · CHEMBRDG-BB 4005390 · 1-(2-aminoethyl)-2-imidazolone · 1-(2-AMINOETHYL)-2-IMIDAZOLIDONE · 1-(2-Aminoethyl)-imidazolidinone · 1-(2-aminoethyl)-2-imidazolidinon · 1-(2-AMINOETHYL)-2-IMIDAZOLIDINONE

https://huagongshe.com/ko/chemical/80480

식별자 및 물리적 특성

CAS No.	6281-42-1
분자식	C5H11N3O
평균 분자량	129.16 g/mol
단동위원소 질량	129.09021197 g/mol
SMILES	NCCN1CCNC1=O
InChIKey	PODSUMUEKRUDEI-UHFFFAOYSA-N
PubChem CID	80480
ChEMBL	CHEMBL3187158
EC No.	228-491-9
DTXSID	DTXSID3044706
현지명	1-(2-아미노에틸)이미다졸리딘-2-온

화학 및 물리적 성질

XLogP	-1.6
극성 표면적	58.4
수소 결합 공여자 수	2
수소 결합 수용자 수	2
회전 가능 결합 수	2
무거운 원자 수	9
형식 전하	0
복잡도	115
Physical Description	Liquid
끓는 점	138-140/0.11mm
밀도	1.137±0.06 g/cm3(Predicted)
저장 조건	under inert gas (nitrogen or Argon) at 2–8 °C
물리적 상태	점성 오일
pKa(산도 계수)	14.42±0.20(Predicted)
색상	오렌지 레드
InChI	InChI=1S/C5H11N3O/c6-1-3-8-4-2-7-5(8)9/h1-4,6H2,(H,7,9)
InChIKey	PODSUMUEKRUDEI-UHFFFAOYSA-N
SMILES	C1(=O)N(CCN)CCN1
EPA	2-Imidazolidinone, 1-(2-aminoethyl)- (6281-42-1)

화학적 성질

Colorless to off-white liquid

안전 및 규제

GHS 분류	DangerH314 (99.5%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P261, P264, P264+P265, P272, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P333+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 553 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
규제 정보	2-Imidazolidinone, 1-(2-aminoethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Imidazolidinone, 1-(2-aminoethyl)- 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: 10-11-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/182162-Imidazolidinone, 1-(2-aminoethyl)-: 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.
Hazard Classes and Categories	Skin Corr. 1B (99.5%)
TSCA 등재 상태	TSCA listed
운송 번호(UN)	3259
관세 코드	29332900
위험 문구(R)	34
위험 표시	Xi,C
안전 문구(S)	22-26-36/37/39-45
위험 등급	8
기존화학 물질	KE-01370
위험 참고 사항	Irritant