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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 75147생성일: 2026년 10월 26일

2-Bromo-4-tert-butylphenol

AKOS BBB/374 · 2-Bromo-4-t-butylphenol · 2-Bromo-4-tert-butylphenol · 4-TERT-BUTYL-2-BROMOPHENOL · 2-Bromo-4-tert-butylphenol >2-broMo-4-(1,1-diMethylethyl)- · Phenol, 2-bromo-4-(1,1-dimethylethyl)-

https://huagongshe.com/ko/chemical/75147

2-Bromo-4-tert-butylphenol 분자 구조식

식별자 및 물리적 특성

CAS No.2198-66-5
분자식C10H13BrO
평균 분자량229.11 g/mol
단동위원소 질량228.01497714 g/mol
SMILESCC(C)(C)c1ccc(O)c(Br)c1
InChIKeyFFRLMQPMGIMHHQ-UHFFFAOYSA-N
PubChem CID75147
ChEMBLCHEMBL2005775
EC No.218-602-9
DTXSIDDTXSID00176395

화학 및 물리적 성질

XLogP3.9
극성 표면적20.2
수소 결합 공여자 수1
수소 결합 수용자 수1
회전 가능 결합 수1
무거운 원자 수12
형식 전하0
복잡도150
녹는점51°C(lit.)
끓는 점113°C/9mmHg(lit.)
밀도1.341±0.06 g/cm3(Predicted)
저장 조건Sealed in dry,Room Temperature
용해도클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태기름
pKa(산도 계수)8.65±0.18(Predicted)
색상투명 무색
InChIInChI=1S/C10H13BrO/c1-10(2,3)7-4-5-9(12)8(11)6-7/h4-6,12H,1-3H3
InChIKeyFFRLMQPMGIMHHQ-UHFFFAOYSA-N
SMILESC1(O)=CC=C(C(C)(C)C)C=C1Br

화학적 성질

White crystalline

안전 및 규제

GHS 분류This chemical does not meet GHS hazard criteria for 12.5% (1 of 8) of reports.WarningH302+H312+H332 (25%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oralacute toxicity, dermalacute toxicity, inhalation]P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 8 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
규제 정보Status: Active Update: 07-03-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/19557
Hazard Classes and CategoriesAcute Tox. 4 (75%)
관세 코드2908190090
위험 표시Xi
위험 등급IRRITANT