3-ブロモベンゾフェノン

3-Bromobenzophenone

HCID 70548CAS 1016-77-9
部分構造検索類似構造を探す

基本情報

標準SMILES
O=C(c1ccccc1)c1cccc(Br)c1
InChIKey
XNUMUNIJQMSNNN-UHFFFAOYSA-N
分子式
C13H9BrO
平均分子量
261.11 g/mol
単同位体質量
259.98368

名称と識別子

優先名称
3-Bromobenzophenone
IUPAC
(3-bromophenyl)-phenylmethanone
現地名
3-ブロモベンゾフェノン
英語名
3-Bromobenzophenone
分子式
C13H9BrO
分子量
261.11

名称と別名

3-Bromobenzophenone1016-77-9EINECS 213-808-5DTXSID10144045RefChem:93238DTXCID5066536213-808-5(3-bromophenyl)(phenyl)methanone(3-bromophenyl)-phenylmethanoneMethanone, (3-bromophenyl)phenyl-MFCD00672015(3-bromophenyl)-phenyl-methanone
名称をさらに表示
3-ブロモフェニルフェニルケトン3-ブロモフェニルフェニルメタノン3-ブロモベンゾフェノン(3-ブロモフェニル)(フェニル)メタノンBromoBenzophenone,m-3-BromobenzoylbenzeneSALOR-INT L169765-1EA3-Bromobenzophenone 98%3-BroMbenzophenone, 97%3-Bromobenzophenone,97%3-bromodibenzenemethylone3-Bromophenylphenyl ketone
SCHEMBL40538Phenyl(3-bromophenyl) ketoneCS-0156563EN300-250756Z385416902m-bromobenzophenone(3-bromophenyl)phenylmethanoneAMY6637

データベース識別子

CAS
1016-77-9
PubChem CID
70548
DTXSID
DTXSID10144045
EC Number
213-808-5
Nikkaji
J217.141D

物性

構造計算による物性

XLogP
4
極性表面積
17.1 Ų
水素結合供与体数
0
水素結合受容体数
1
回転可能結合数
2
重原子数
15

物理化学的性質

融点
74.5 · 74.5-77.5 °C(lit.)
沸点
347.5 °C · 347.5°C (rough estimate)
比重(密度)
1.4245 · 1.4245 (rough estimate)
屈折率
1.513 · 1.5130 (estimate)
貯蔵温度
Inert atmosphere,Room Temperature
InChI
InChI=1S/C13H9BrO/c14-12-8-4-7-11(9-12)13(15)10-5-2-1-3-6-10/h1-9H

化学的性質

化学的特性Off-white to beige-yellowish or orange powder

安全と法規制

GHS分類

GHS Classification · 5 件

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 6 reports by companies from 3 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.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

安全データ

wgk
3
hs_code
29147000
risk_code
36/37/38
hazard_code
Xi
safety_code
22-24/25-37/39-26
ストレージクラス
11 - Combustible Solids

化学と産業

応用分野

使用3-Bromobenzophenone reacts with diphenylmethane to yield the bromo-TPE intermediate mTPE-Br, which serves as a building block for tetraphenylethylene-based derivatives[2].

上流・下流製品情報

サプライヤー50 社

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
郑州圣壹新材料科技有限公司0371-63891666 18037898020 · [email protected]

関連反応

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