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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 89028생성일: 2026년 10월 26일

1-(Chloromethyl)-2-(trifluoromethyl)benzene

TIMTEC-BB SBB006695 · α'-chloro-α,α,α-trifluoro-o-xylene · à'-chloro-à,à,à-trifluoro-o-xylene · o-(Trifluoromethyl)Benzyl Chloride · 2-(TRIFLUOROMETHYL)BENZYL CHLORIDE · o-Xylene, a'-chloro-a,a,a-trifluoro- · 2-(Trifluoromethyl)benzylchloride97% · 2-(Trifluoromethyl)benzyl chloride 97%

https://huagongshe.com/ko/chemical/89028

1-(Chloromethyl)-2-(trifluoromethyl)benzene 분자 구조식

식별자 및 물리적 특성

CAS No.21742-00-7
분자식C8H6ClF3
평균 분자량194.58 g/mol
단동위원소 질량194.01101253 g/mol
SMILESFC(F)(F)c1ccccc1CCl
InChIKeyBBXDMCQDLOCXRA-UHFFFAOYSA-N
PubChem CID89028
EC No.244-560-6
DTXSIDDTXSID20176135

화학 및 물리적 성질

XLogP3.2
극성 표면적0
수소 결합 공여자 수0
수소 결합 수용자 수3
회전 가능 결합 수1
무거운 원자 수12
형식 전하0
복잡도144
끓는 점67-68°C 12mm
밀도1.337 g/mL at 25 °C(lit.)
굴절률n20/D 1.469(lit.)
인화점158 °F
저장 조건under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태투명한 액체
색상무색 내지 거의 무색
비중1.337
BRN389380
InChI1S/C8H6ClF3/c9-5-6-3-1-2-4-7(6)8(10,11)12/h1-4H,5H2
InChIKeyBBXDMCQDLOCXRA-UHFFFAOYSA-N
SMILESFC(F)(F)c1ccccc1CCl

화학적 성질

2-(Trifluoromethyl)benzyl chloride is CLEAR LIGHT YELLOW LIQUID

안전 및 규제

GHS 분류DangerH314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and CategoriesSkin Corr. 1B (100%)
수질 위해 등급(WGK)3
운송 번호(UN)UN 3265 8/PG 2
관세 코드29039990
위험 문구(R)34-36/37
위험 표시C
안전 문구(S)23-26-27-36/37/39-45
포장분류III
위험 등급8Eye Dam. 1Skin Corr. 1BSTOT SE 3
위험 참고 사항Corrosive/Lachrymatory
저장 분류8A - Combustible corrosive hazardous materials

용도

용도

2-(Trifluoromethyl)benzyl chloride is used in preparation of phenyl-substituted carboxylic acid derivatives as PAI-1 inhibitors.