(트리플루오로메틸)벤조산
2-(Trifluoromethyl)benzoic acid
데이터를 보충하는 중입니다. 잠시 후 페이지를 새로 고치면 최신 내용을 볼 수 있습니다
기본 정보
- CAS
137938-95-5- 표준 SMILES
O=C(O)c1ccccc1C(F)(F)F- InChIKey
FBRJYBGLCHWYOE-UHFFFAOYSA-N- 분자식
- C8H5F3O2
- 평균 분자량
- 190.12 g/mol
- 단동위원소 질량
- 190.02416406
개요
2-(trifluoromethyl)benzoic acid is a benzoic acid carrying a trifluoromethyl substituent at the 2-position. It is a member of benzoic acids and a member of (trifluoromethyl)benzenes.
이름 및 식별자
- 우선 이름
- 2-(Trifluoromethyl)benzoic acid
- IUPAC
- 2-(trifluoromethyl)benzoic acid
- 현지명
- (트리플루오로메틸)벤조산
- 영어명
- (trifluoromethyl)benzoic acid
- 분자식
- C8H5F3O2
- 분자량
- 190.1193096
이름 및 동의어
2-(Trifluoromethyl)benzoic acid433-97-62-Trifluoromethylbenzoic acidalpha,alpha,alpha-Trifluoro-o-toluic acido-Trifluoromethylbenzoic acidBenzoic acid, 2-(trifluoromethyl)-2-TFMBA0R1CK7MZUACHEBI:60694NSC-88326DTXSID90870537RefChem:462548
이름 더 보기
(트리플루오로메틸)벤조산(trifluoromethyl)benzoic acid
ortho-trifluormethylbenzoic acidDTXCID10818254207-093-9MFCD00002476o-(trifluoromethyl)benzoic acido-CARBOXYBENZOTRIFLUORIDEtrifluoromethylbenzoic acid2-trifluoromethyl benzoic acid
데이터베이스 식별자
- CAS
137938-95-5、433-97-6、71990-01-7- PubChem CID
- 9899
- DTXSID
DTXSID90870537- ChEBI
CHEBI:60694- UNII
- 0R1CK7MZUA
- EC Number
- 207-093-9、276-274-2
- Nikkaji
- J141.645F
물성
구조 계산 물성보충 중
- XLogP
- 1.3
- 극성 표면적
- 37.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 13
- 형식 전하
- 0
- 복잡도
- 200
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 77 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Benzoic acid, 2-(trifluoromethyl)-
Council Directive (EEC) No 414/1991 (Repealed by Reg. EC No 1107/2009 (amended))
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
2-Trifluoromethylbenzoic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
화학 및 산업
용도 및 제조
General Manufacturing InformationBenzoic acid, 2-(trifluoromethyl)-: ACTIVE
관련 반응
53건
화합물 노트
불러오는 중…