페닐에틸에탄올아민

페닐에틸에탄올아민 · N-에틸-N-히드록시에틸아닐린 · 2-(N-ETHYLANILINO)ETHANOL · N-ETHYL-N-(2-HYDROXYETHYL)ANILINE · N-Ethyl-N-(2-Hydroxyethyl)-Aniline (Peea) · TIMTEC-BB SBB007817 · N-Ethylanilinoethanol · 2-(Ethylanilino)ethanol

https://huagongshe.com/ko/chemical/62338

식별자 및 물리적 특성

CAS No.	92-50-2
분자식	C10H15NO
평균 분자량	165.23 g/mol
단동위원소 질량	165.1153641 g/mol
SMILES	CCN(CCO)c1ccccc1
InChIKey	HYVGFUIWHXLVNV-UHFFFAOYSA-N
PubChem CID	62338
EC No.	202-160-9
DTXSID	DTXSID3059056
현지명	페닐에틸에탄올아민

화학 및 물리적 성질

XLogP	2.1
극성 표면적	23.5
수소 결합 공여자 수	1
수소 결합 수용자 수	2
회전 가능 결합 수	4
무거운 원자 수	12
형식 전하	0
복잡도	110
녹는점	36-38 °C (lit.)
끓는 점	268 °C (lit.)
밀도	1.02
증기압	1Pa at 25℃
굴절률	1.5605-1.5625
인화점	120 °C
저장 조건	Keep in dark place,Inert atmosphere,Room temperature
용해도	클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태	액체
pKa(산도 계수)	14.66±0.10(Predicted)
색상	투명한 무색~노란색~주황색, 보관 시 제품이 어두워질 수 있음
용해도	4.975g/L(20℃)
InChI	1S/C10H15NO/c1-2-11(8-9-12)10-6-4-3-5-7-10/h3-7,12H,2,8-9H2,1H3
InChIKey	HYVGFUIWHXLVNV-UHFFFAOYSA-N
SMILES	CCN(CCO)c1ccccc1
LogP(분배 계수)	1.88 at 20℃
NIST	Ethanol, 2-(ethylphenylamino)-(92-50-2)
EPA	Ethanol, 2-(ethylphenylamino)- (92-50-2)

화학적 성질

clear yellow liquid after melting

안전 및 규제

GHS 분류	DangerH302 (81.5%): Harmful if swallowed [Warning Acute toxicity, oral]P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 189 reports by companies from 13 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
규제 정보	Chemical: Ethanol, 2-(ethylphenylamino)-Status: Active Update: 28-12-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/27621Ethanol, 2-(ethylphenylamino)-: 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	Acute Tox. 4 (81.5%)
수질 위해 등급(WGK)	2
TSCA 등재 상태	TSCA listed
RTECS 번호	KL0878000
관세 코드	29221990
위험 문구(R)	22-36/37/38-36
위험 표시	Xn
안전 문구(S)	36/37/39-39-26
기존화학 물질	KE-14032
위험 등급	Acute Tox. 4 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
저장 분류	11 - Combustible Solids

용도

2-(N-Ethylanilino) ethanol was used in the preparation of azo compound N-ethyl-N-(2-hydroxylethyl)-4-(2-cyano-4-nitrophenylazo) aniline (AZ1)2.

일반 설명

2-(N-Ethylanilino) ethanol couples with 2-amino-5-formylthiophene during the synthesis of nonlinear optical chromophores. It undergoes azo coupling with 2-cyan-4-nitroaniline to yield azochromophore AZ1.