2-Chloro-1-(2,4-difluorophenyl)ethanone (HCID 588083)

이름 및 식별자

우선 이름: 2-Chloro-1-(2,4-difluorophenyl)ethanone
IUPAC: 2-chloro-1-(2,4-difluorophenyl)ethanone
영어명: 2-Chloro-2',4'-difluoroacetophenone
분자식: C8H5ClF2O
분자량: 190.57

이름 및 동의어

51336-94-82-Chloro-1-(2,4-difluorophenyl)ethanoneUENGBOCGGKLVJJ-UHFFFAOYSA-RefChem:468296620-343-5InChI=1/C8H5ClF2O/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3H,4H22-Chloro-2',4'-difluoroacetophenone2,4-Difluorophenacyl Chloride2-Chloro-1-(2,4-Difluorophenyl)Ethan-1-OneMFCD00013252Voriconazole Impurity N1-(2,4-difluorophenyl)-2-chloroethan-1-one

이름 더 보기

2,4-difluorophenacyl chloride ,2-chloro-1-(2,4-difluorophenyl)ethanone2-Chloro-2Voriconazole RC1TIMTEC-BB SBB006665Voriconazole Impurity 62,4-Difluorophenacylchloride98%2,4-Difluorophenacyl chloride 98%2'-Chloro 2,4-fluoro acetophenone

Ethanone, 2-chloro-1-(2,4-difluorophenyl)-CHEMBL105349ALPHA-CHLORO-2,4-DIFLUOROACETOPHENONEChloromethyl 2,4-difluorophenyl ketone2-Chloro-2\',4\'-difluoroacetophenone2-Chloro-1-(2,4-difluoro-phenyl)-ethanone2-Chloro-2,4-difluoroacetophenone2',4'-DIFLUORO-2-CHLOROACETOPHENONE

데이터베이스 식별자

CAS: 51336-94-8
PubChem CID: 588083
DTXSID: DTXSID40343185
ChEMBL: CHEMBL105349
UNII: R3G2FBJ2J6
EC Number: 620-343-5
Nikkaji: J267.331B

물성

구조 계산 물성

XLogP: 2.4
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 2
무거운 원자 수: 12
형식 전하: 0
복잡도: 174

물리화학적 성질

녹는점: 44 · 44-48 °C(lit.)
끓는 점: 240.9 · 240.9±25.0 °C(Predicted)
밀도: 1.3544 · 1.3544 (estimate)
인화점: 230 °F · >230 °F
저장 조건: 2 · Inert atmosphere,2-8°C
용해도: 클로로포름(약간 용해됨)
물리적 상태: 고체
색상: 연한 갈색
BRN: 1943217 · 1943217
InChI: InChI=1S/C8H5ClF2O/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3H,4H2
InChIKey: UENGBOCGGKLVJJ-UHFFFAOYSA-N
SMILES: C(=O)(C1=CC=C(F)C=C1F)CCl

화학적 성질

white crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (98%): 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 49 reports by companies from 6 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory InformationStatus: Active Update: 28-09-2010 https://echa.europa.eu/registration-dossier/-/registered-dossier/18226

Hazard Classes and CategoriesSkin Corr. 1B (98%)

안전 데이터

wgk: 3
ridadr: UN 3261 8/PG 2
HS 번호: 29147000
risk_code: 34-37
hazard_code: C,Xi
safety_code: 26-36/37/39-45-25-27
포장분류: II
위험 등급: 8
F 고인화성물질: 10-21
위험 참고 사항: Corrosive/Irritant/Lachrymatory
Hazard Classifications: Acute Tox. 1 InhalationAcute Tox. 3 OralAquatic Chronic 1Eye Dam. 1Skin Corr. 1BSkin Sens. 1A
스토리지 클래스: 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials