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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 2829289생성일: 2026년 11월 4일

Ethyl 4-(4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

4(4-HO-PH)2,7,7-TRI-ME-5-OXO-1,4,5,6,7,8-6H-QUINOLINE-3-CARBOXYLIC ACID ET ESTER · ethyl 4-(4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate · 3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-4-(4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-, ethyl ester

https://huagongshe.com/ko/chemical/2829289

Ethyl 4-(4-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate 분자 구조식

식별자 및 물리적 특성

CAS No.292852-47-2
분자식C21H25NO4
평균 분자량355.4 g/mol
단동위원소 질량355.17835828 g/mol
SMILESCCOC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)C1c1ccc(O)cc1
InChIKeyGFDTWMMIHOBFFQ-UHFFFAOYSA-N
PubChem CID2829289
EC No.151-870-4

화학 및 물리적 성질

XLogP3.3
극성 표면적75.6
수소 결합 공여자 수2
수소 결합 수용자 수5
회전 가능 결합 수4
무거운 원자 수26
형식 전하0
복잡도665
녹는점238-240 °C
끓는 점525.5±50.0 °C(Predicted)
밀도1.22±0.1 g/cm3(Predicted)
pKa(산도 계수)9.72±0.30(Predicted)

안전 및 규제

GHS 분류DangerH301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and CategoriesAcute Tox. 3 (100%)