2,2-BIS(트리플루오로메틸)-2-수산화아세트산

3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl)propionic Acid

HCID 2725043

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 662-22-6
표준 SMILES: O=C(O)C(O)(C(F)(F)F)C(F)(F)F
InChIKey: CMQUGOHGJUTDGZ-UHFFFAOYSA-N
분자식: C4H2F6O3
평균 분자량: 212.05 g/mol
단동위원소 질량: 211.99081289

이름 및 식별자

우선 이름: 3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl)propionic Acid
IUPAC: 3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propanoic acid
현지명: 2,2-BIS(트리플루오로메틸)-2-수산화아세트산
영어명: 2,2-Bis(trifluoromethyl)-2-hydroxyacetic acid
분자식: C4H2F6O3
분자량: 212.05

이름 및 동의어

3,3,3-Trifluoro-2-hydroxy-2-(trifluoromethyl)propionic AcidRefChem:485056672-609-5662-22-62,2-Bis(trifluoromethyl)-2-hydroxyacetic acid3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propanoic Acid2,2-BIS(TRIFLUOROMETHYL)-2-HYDROXYACETICACIDMFCD001906312-Hydroxy-3,3,3-trifluoro-2-(trifluoromethyl)propionic acidC4H2F6O34fp1SCHEMBL569050

이름 더 보기

2,2-BIS(트리플루오로메틸)-2-수산화아세트산2,2-Bis(Trifluoromethyl)GlycoHexafluoro-2-hydroxyisobutyric acid2,2-Bis(trifluoromethyl)glycolic acidPerfluoro-2-hydroxy-2-methylpropanoicacid95%Perfluoro-2-hydroxy-2-methylpropanoic acid 95%

3,3,3-Trifluoro-2-hydroxy-2-trifluoromethylpropionic Acid2,2-bis-trifluoromethyl 2-hydroxyacetic acidPerfluoro-2-hydroxy-2-methylpropanoic acidT25872-Hydroxy-2,2-bis(trifluoromethyl)acetic AcidBFMPropanoic acid, 3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)-2,2-BIS(TRIFL

데이터베이스 식별자

CAS: 662-22-6
PubChem CID: 2725043
DTXSID: DTXSID00369341
EC Number: 672-609-5
Nikkaji: J3.200.815A

물성

구조 계산 물성

XLogP: 1.2
극성 표면적: 57.5 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 9
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 201

물리화학적 성질

녹는점: 30 °C · 30°C
끓는 점: 153 · 153-156°C
밀도: 1 · 1,183 g/cm3
인화점: 153 · 153-156°C
저장 조건: -20 °C · -20°C Freezer, Under inert atmosphere
용해도: 클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 고체
산도 계수 (pKa): 0.84 · 0.84±0.22(Predicted)
색상: 회백색
BRN: 1790446 · 1790446
EPA: 2 · 2,2-bis(Trifluoromethyl)-2-hydroxyacetic acid (662-22-6)

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 43 reports by companies from 3 notifications to the ECHA C&L Inventory.；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.