4-클로로-3-(트리플루오로메틸)벤질알코올

4-Chloro-3-(trifluoromethyl)benzyl alcohol

HCID 2778111

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 65735-71-9
표준 SMILES: OCc1ccc(Cl)c(C(F)(F)F)c1
InChIKey: JRYCPYROZOWIDJ-UHFFFAOYSA-N
분자식: C8H6ClF3O
평균 분자량: 210.58 g/mol
단동위원소 질량: 210.005927

이름 및 식별자

우선 이름: 4-Chloro-3-(trifluoromethyl)benzyl alcohol
IUPAC: [4-chloro-3-(trifluoromethyl)phenyl]methanol
현지명: 4-클로로-3-(트리플루오로메틸)벤질알코올
영어명: 4-Chloro-3-(trifluoromethyl)benzyl alcohol
분자식: C8H6ClF3O
분자량: 210.58

이름 및 동의어

65735-71-94-Chloro-3-(trifluoromethyl)benzyl alcoholDTXSID40380777RefChem:291623DTXCID60331802(4-Chloro-3-(trifluoromethyl)phenyl)methanol[4-chloro-3-(trifluoromethyl)phenyl]methanolMFCD016315384-Chloro-3-trifluoromethylbenzyl alcohol(4-chloro-3-trifluoromethyl-phenyl)-methanol[4-chloro-3-(trifluoromethyl)phenyl]methan-1-olBenzenemethanol, 4-chloro-3-(trifluoromethyl)-

이름 더 보기

4-클로로-3-(트리플루오로메틸)벤질알코올RARECHEM AL BD 02862-Chloro-5-(hydroxymethyl)benzotrifluoride4-Chloro-3-(trifluoromethyl)benzyl alcohol, 97+%

SCHEMBL932893SCHEMBL16952200SCHEMBL29556319CL8726SBB094393AKOS015849959AC-4169CS-W015096

데이터베이스 식별자

CAS: 65735-71-9
PubChem CID: 2778111
DTXSID: DTXSID40380777
EC Number: 670-759-6

물성

구조 계산 물성

XLogP: 2.5
극성 표면적: 20.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 4
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 171

물리화학적 성질

녹는점: 44 · 44-46°C
끓는 점: 236 ℃ · 236℃
밀도: 1.416 · 1.416
인화점: 97 ℃ · 97℃
저장 조건: Sealed in dry,Room Temperature
물리적 상태: 융합된 고체
산도 계수 (pKa): 13.78 · 13.78±0.10(Predicted)
색상: 회백색

화학적 성질

colorless to light yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 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.