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HCID 33711생성일: 2026년 10월 27일

3-tert-부틸톨루엔

3-tert-부틸톨루엔 · m-t-butyltoluene · 3-TERT-BUTYLTOLUENE · m-tert-Butyltoluene · toluene,m-tert-butyl- · Toluene, m-tert-butyl- · 3-tert-Butyltoluene >1-METHYL-3-t-BUTYLBENZENE · 1-TERT-BUTYL-3-METHYLBENZENE

https://huagongshe.com/ko/chemical/33711

3-tert-부틸톨루엔 분자 구조식

식별자 및 물리적 특성

CAS No.1075-38-3
분자식C11H16
평균 분자량148.24 g/mol
단동위원소 질량148.12520051 g/mol
SMILESCc1cccc(C(C)(C)C)c1
InChIKeyJTIAYWZZZOZUTK-UHFFFAOYSA-N
PubChem CID33711
EC No.677-961-3
DTXSIDDTXSID10148068
현지명3-tert-부틸톨루엔

화학 및 물리적 성질

XLogP4.5
극성 표면적0
수소 결합 공여자 수0
수소 결합 수용자 수0
회전 가능 결합 수1
무거운 원자 수11
형식 전하0
복잡도118
Kovats Retention Index1072106710681067.51053.61056.11051.121062.3108310521322133013321343135313611296
녹는점-41 °C
끓는 점189 °C
밀도0.87
굴절률1.4940-1.4960
물리적 상태투명한 액체
색상무색 내지 거의 무색
헨리 상수8.2×10-4 mol/(m3Pa) at 25℃, Yaws (2003)

안전 및 규제

GHS 분류DangerH226 (20%): Flammable liquid and vapor [Warning Flammable liquids]H301 (20%): Toxic if swallowed [Danger Acute toxicity, oral]H302 (80%): Harmful if swallowed [Warning Acute toxicity, oral]H311 (20%): Toxic in contact with skin [Danger Acute toxicity, dermal]H319 (80%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H331 (100%): Toxic if inhaled [Danger Acute toxicity, inhalation]H335 (80%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]H411 (80%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P210, P233, P240, P241, P242, P243, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P316, P319, P321, P330, P337+P317, P361+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard Classes and CategoriesFlam. Liq. 3 (20%)Acute Tox. 3 (20%)Acute Tox. 3 (100%)
운송 번호(UN)2667
관세 코드2902.90.3050
포장분류III
위험 등급6.1