2-(5-클로로-2H-벤조트리아졸-2-일)-4,6-비스(1,1-다이메틸에틸)페놀
2,4-Di-tert-butyl-6-(5-chloro-2H-benzotriazol-2-yl)phenol
기본 정보
- CAS
3864-99-1- 표준 SMILES
CC(C)(C)c1cc(-n2nc3ccc(Cl)cc3n2)c(O)c(C(C)(C)C)c1- InChIKey
UWSMKYBKUPAEJQ-UHFFFAOYSA-N- 분자식
- C20H24ClN3O
- 평균 분자량
- 357.9 g/mol
- 단동위원소 질량
- 357.1607901
개요
5-Chloro-2-(3,5-di-tert-butyl-2-hydroxyphenyl)-2H-benzotriazole is a member of triazoles.
이름 및 식별자
- 우선 이름
- 2,4-Di-tert-butyl-6-(5-chloro-2H-benzotriazol-2-yl)phenol
- IUPAC
- 2,4-ditert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol
- 현지명
- 2-(5-클로로-2H-벤조트리아졸-2-일)-4,6-비스(1,1-다이메틸에틸)페놀
- 영어명
- 2-(2'-Hydroxy-3',5'-di-tert-butylphenyl)-5-chlorobenzotriazole
- 분자식
- C20H24ClN3O
- 분자량
- 357.88
이름 및 동의어
3864-99-12,4-Di-tert-butyl-6-(5-chloro-2H-benzotriazol-2-yl)phenolUV-327Phenol, 2-(5-chloro-2H-benzotriazol-2-yl)-4,6-bis(1,1-dimethylethyl)-17TJE602RXEINECS 223-383-82,4-Di-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenolANTIOXIDANT 3272-(5-Chloro-2H-benzotriazol-2-yl)-4,6-di-tert-butylphenol2-(3',5'-Di-tert-butyl-2'-hydroxyphenyl)-5-chloro-2H-benzotriazoleDTXSID4038893LA-34
이름 더 보기
2-(5-클로로-2H-벤조트리아졸-2-일)-4,6-비스(1,1-다이메틸에틸)페놀2,4-다이-t-뷰틸-6-(5-클로로벤조트라이아졸-2-일)페놀2-(5-클로로-2H-벤조트리아졸-2-일)-4,6-비스(1,1-다이메틸에틸)페놀(2-(5-CHLORO-2H-B...2-(3,5-다이-터트-뷰틸-2-하이드록시페닐)-5-클로로-2H-벤조트라이졸자외선흡수제UV-327UV ABSORBER 3272,4-di-tert-butyl-6-(5-chloro-2H-benzo-triazol-2-2,4-DI-TERT-BUTYL-6-(5-CHLOROBENZOTRIAZOL-2-YL) PHENOL2-(3,5-DI-TERT-BUTYL-2-HYDROXYPHENYL)-5-CHLORO-2H-BENZOTRIAZOLE2-(5-Chloro-2H-benzotriazol-2-yl)-4,6-bis(1,1-dimethylethyl)-phenolDBHCBditBu-ClBZT
물성
구조 계산 물성
- XLogP
- 6.9
- 극성 표면적
- 50.9 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 25
- 형식 전하
- 0
- 복잡도
- 473
실험 및 물리화학적 성질
Endocrine DisruptorsPotential endocrine disrupting compound
Melting Point153 - 154 °C
Food Contact Substances
FCS -> FDA Cumulative Estimated Daily Intake (CEDI)
FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications
Physical DescriptionSolid
물리화학적 성질
- 녹는점
- 150 · 150-153 °C(lit.)
- 끓는 점
- 469.2 · 469.2±55.0 °C(Predicted)
- 밀도
- 1 · 1,26 g/cm3
- 인화점
- 234 °C · 234°C
- 저장 조건
- Keep in dark place,Sealed in dry,Room Temperature
- 용해도
- 클로로포름, 아세트산에틸(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 9.23 · 9.23±0.48(Predicted)
- 색상
- 황백색에서 연한 노란색
- 안정성
- 감광성
- InChI
- InChI=1S/C20H24ClN3O/c1-19(2,3)12-9-14(20(4,5)6)18(25)17(10-12)24-22-15-8-7-13(21)11-16(15)23-24/h7-11,25H,1-6H3
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 3.4% (21 of 625) of reports.
Warning
H373 (87%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]
P260, P273, P319, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 625 reports by companies from 25 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Not Classified
유해성 정보
Regulatory Information
Chemical: Phenol, 2-(5-chloro-2H-benzotriazol-2-yl)-4,6-bis(1,1-dimethylethyl)-
Hazard Traits - Bioaccumulation; Environmental Persistence
Substance: 2,4-di-tert-butyl-6-(5-chlorobenzotriazol-2-yl)phenol (UV-327)
Phenol, 2-(5-chloro-2H-benzotriazol-2-yl)-4,6-bis(1,1-dimethylethyl)-: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Phenolic benzotriazoles: Environment tier II assessment
Hazard Classes and CategoriesSTOT RE 2 (87%)
안전 데이터
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- 3425000
- ridadr
- 3077
- HS 번호
- 29339900
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- 위험 등급
- 9
화학 및 산업
약리 정보
Cellular LocationsMembrane
용도 및 제조
General Manufacturing InformationPhenol, 2-(5-chloro-2H-benzotriazol-2-yl)-4,6-bis(1,1-dimethylethyl)-: ACTIVE
응용 분야
용도2,4-Di-tert-butyl-6-(5-chloro-2H-benzotriazol-2-yl)phenol is a UV absorber.
상·하류 제품 정보
상류 원료
하류 제품
관련 반응
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