N-클로로에틸-N-에틸아닐린

N-클로로에틸-N-에틸아닐린 · emery5770 · N-Chloroethyl-N-ethy · ethyl(chloroethyl)aniline · N-Chlorethyl-N-ethylanilin · 4-chloro-n,n-diethyl-anilin · N-CHLOROETHYL-N-ETHYLANILINE · N-ETHYL-N-CHLOROETHYL ANILINE

https://huagongshe.com/ko/chemical/7093

식별자 및 물리적 특성

CAS No.	92-49-9
분자식	C10H14ClN
평균 분자량	183.68 g/mol
단동위원소 질량	183.08147713 g/mol
SMILES	CCN(CCCl)c1ccccc1
InChIKey	DBDNQNARCHWMSP-UHFFFAOYSA-N
PubChem CID	7093
EC No.	202-159-3
DTXSID	DTXSID6052615
현지명	N-클로로에틸-N-에틸아닐린

화학 및 물리적 성질

XLogP	3.4
극성 표면적	3.2
수소 결합 공여자 수	0
수소 결합 수용자 수	1
회전 가능 결합 수	4
무거운 원자 수	12
형식 전하	0
복잡도	110
물질 분류	Nitrogen Compounds -> Other Aromatics (Nitrogen)
Color/Form	NEEDLES FROM ALCOHOL
용해도	SOL IN HOT ALCOHOL
끓는 점	251-253 °C302.39°C (rough estimate)
Decomposition	When heated to decomposition it emits toxic vapors of /Nitrogen Oxides and Hydrogen Chloride/.
녹는점	45.5-46.5 °C46°C
Physical Description	Solid[HSDB]
밀도	1.0821 (rough estimate)
굴절률	1.6100 (estimate)
pKa(산도 계수)	5.52±0.50(Predicted)
InChI	InChI=1S/C10H14ClN/c1-2-12(9-8-11)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3
InChIKey	DBDNQNARCHWMSP-UHFFFAOYSA-N
SMILES	C1(N(CCCl)CC)=CC=CC=C1
EPA	N-Ethyl-N-(2-chloroethyl)aniline (92-49-9)

안전 및 규제

GHS 분류	DangerH301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]P262, P264, P270, P280, P301+P316, P302+P352, P316, P321, P330, P361+P364, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 37 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
규제 정보	Chemical: Benzenamine, N-(2-chloroethyl)-N-ethyl-
유해성 요약	Emergency treatment: Mustard gas[HSDB] Corrosive to skin[RTECS] See Nitrogen mustard (HN-1).
Hazard Classes and Categories	Acute Tox. 3 (100%)
처리 방법	SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.
유해 작용	Dermatotoxin - Skin burns.
TSCA Test Submissions	N-(2-chloroethyl)-N-ethylaniline was evaluated for acute dermal toxicity in 4 groups of 4 New Zealand White rabbits (sex not indicated) administered 0.100, 0.215, 0.464, and 1.00 ml/kg bw doses of the test substance to the abdominal skin under occlusive conditions. The skin of 2 rabbits in each group was abraded prior to application of the test substance. Animals were observed for 14 days following treatment. The use of controls was not reported. Mortalities included one at both the 0.215 ml/kg and 0.464 ml/kg levels, and 4 at the 1.00 ml/kg level. The LD50 (and 95% confidence limits) were determined by the moving average method to be 464 ml/kg (0.270 - 0.799). Clinical signs included depression and nasal discharge at the 0.100 and 0.215 levelshunched posture, emaciation, and half closed eyes at the 0.215 l ml/kg level. Additional signs observed at 0.464 ml/kg level included wheezing, diarrhea, excessive salivation, hyperactivity, and exceptionally blue eyes. The single high dose rabbit that survived long enough for observation displayed the additional signs of depressed righting and placement reflexes and labored respiration. Signs of dermal irritation were seen in all treatment groups. Gross necropsy of rabbits that died revealed congested lungs at all levels

용도

N-Chloroethyl-N-ethylaniline is used as an intermediate in the synthesis of dyes as an aniline organic compound.