Ethanone, 2-chloro-1,2-diphenyl-

HCID 95343CAS 447-31-4

기본 정보

표준 SMILES: O=C(c1ccccc1)C(Cl)c1ccccc1
InChIKey: RXDYOLRABMJTEF-UHFFFAOYSA-N
분자식: C14H11ClO
평균 분자량: 230.69 g/mol
단동위원소 질량: 230.0498427

이름 및 식별자

우선 이름: Ethanone, 2-chloro-1,2-diphenyl-
IUPAC: 2-chloro-1,2-diphenylethanone
영어명: DESYL CHLORIDE
분자식: C14H11ClO
분자량: 230.69

이름 및 동의어

Desyl chloride2-Chloro-2-phenylacetophenone1,2-Diphenyl-2-chloroethanonealpha-Chlorobenzyl phenyl ketoneAcetophenone, 2-chloro-2-phenyl-NSC 2883Ethanone, 2-chloro-1,2-diphenyl-2-Chloro-1,2-diphenylethoneEINECS 207-181-7alpha-Chloro-alpha-phenyl acetophenoneBRN 0744474Acetophenone, alpha-chloro-alpha-phenyl-

이름 더 보기

Desylchloride,98%AKOS BBS-00004804AVO Desyl ChlorideALPHA-CHLORODEOXYBENZOINALPHA-CHLORODESOXYBENZOIN2-chloro-1,2-diphenyl-ethonω-chloro-ω-phenylacetophenoneà-chloro-à-phenylacetophenone

AI3-22036Ethone, 2-chloro-1,2-diphenyl-3-07-00-02106 (Beilstein Handbook Reference)RefChem:592567Acetophenone, 2-chloro-2-phenyl-(8CI)Ethone, 2-chloro-1,2-diphenyl-(9CI)447-31-42-Chloro-1,2-diphenylethanone

데이터베이스 식별자

CAS: 447-31-4
PubChem CID: 95343
DTXSID: DTXSID50870538
EC Number: 207-181-7
Nikkaji: J11.380H

물성

구조 계산 물성

XLogP: 3.4
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 3
무거운 원자 수: 16
형식 전하: 0
복잡도: 227

물리화학적 성질

녹는점: 62 · 62-63 °C(lit.)
끓는 점: 330 °C · 330°C (rough estimate)
밀도: 1.1223 · 1.1223 (rough estimate)
굴절률: 1.526 · 1.5260 (estimate)
저장 조건: 30 °C · Store below +30°C.
물리적 상태: powder to crystal
색상: 흰색에서 거의 흰색
BRN: 744474 · 744474
InChI: InChI=1S/C14H11ClO/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13H
InChIKey: RXDYOLRABMJTEF-UHFFFAOYSA-N
SMILES: C(=O)(C1=CC=CC=C1)C(Cl)C1=CC=CC=C1
EPA: Desyl chloride (447-31-4)

화학적 성질

off-white to light beige powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H318 (90.9%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 4 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.