2-ベンゾイル-5-(ドデシルオキシ)フェノール

4-Dodecyloxy-2-hydroxybenzophenone

HCID 76330
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基本情報

CAS
2985-59-3
標準SMILES
CCCCCCCCCCCCOc1ccc(C(=O)c2ccccc2)c(O)c1
InChIKey
ARVUDIQYNJVQIW-UHFFFAOYSA-N
分子式
C25H34O3
平均分子量
382.5 g/mol
単同位体質量
382.25079494

名称と識別子

優先名称
4-Dodecyloxy-2-hydroxybenzophenone
IUPAC
(4-dodecoxy-2-hydroxyphenyl)-phenylmethanone
現地名
2-ベンゾイル-5-(ドデシルオキシ)フェノール
英語名
4-Dodecyloxy-2-hydroxybenzophenone
分子式
C25H34O3
分子量
382.54

名称と別名

2985-59-34-Dodecyloxy-2-hydroxybenzophenone2-hydroxy-4-dodecyloxybenzophenoneEINECS 221-049-6Methanone, [4-(dodecyloxy)-2-hydroxyphenyl]phenyl-DTXSID6062755Methanone, (4-(dodecyloxy)-2-hydroxyphenyl)phenyl-RefChem:522546DTXCID6038081221-049-64-(DODECYLOXY)-2-HYDROXY BENZOPHENONE(4-(Dodecyloxy)-2-hydroxyphenyl)(phenyl)methanone
名称をさらに表示
4-ドデシルオキシ-2-ヒドロキシベンゾフェノン2-ヒドロキシ-4-(ドデシルオキシ)ベンゾフェノン2-ベンゾイル-5-(ドデシルオキシ)フェノールUV 5382-Hydroxy-4-dodecyclobenzophenone2-Hydroxy-4-Dodecoxy Benzophenone(4-dodecoxy-2-hydroxy-phenyl)-phenyl-methanone[4-(dodecyloxy)-2-hydroxyphenyl]phenyl-methanon(2-hydroxy-4-lauryloxy-phenyl)-phenyl-methanone
(4-dodecoxy-2-hydroxyphenyl)-phenylmethanone[4-(dodecyloxy)-2-hydroxyphenyl](phenyl)methanone2-benzoyl-5-(dodecyloxy)phenolBenzophenone, 4-dodecyloxy-2-hydroxy-2-Hydroxy-4-(dodecyloxy)benzophenoneMFCD00026578SCHEMBL38596SCHEMBL29365734

データベース識別子

CAS
2985-59-3
PubChem CID
76330
DTXSID
DTXSID6062755
EC Number
221-049-6
Nikkaji
J47.620J

物性

構造計算による物性

XLogP
9
極性表面積
46.5 Ų
水素結合供与体数
1
水素結合受容体数
3
回転可能結合数
14
重原子数
28

物理化学的性質

融点
49 · 49-50 °C
沸点
506.3 · 506.3±35.0 °C(Predicted)
比重(密度)
1.029 · 1.029±0.06 g/cm3(Predicted)
酸解離定数(Pka)
7.58 · 7.58±0.35(Predicted)
CAS データベース
2985 · 2985-59-3(CAS DataBase Reference)
EPAの化学物質情報
4 · 4-Dodecyloxy-2-hydroxybenzophenone (2985-59-3)

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 11.4% (5 of 44) of reports.

Warning

H315 (88.6%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (88.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (88.6%): 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 44 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 5 of 44 reports by companies.；There are 2 notifications provided by 39 of 44 reports by companies with hazard statement code(s).；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

Regulatory InformationChemical: Methanone, [4-(dodecyloxy)-2-hydroxyphenyl]phenyl-
Hazard Classes and CategoriesSkin Irrit. 2 (88.6%)；Eye Irrit. 2 (88.6%)；STOT SE 3 (88.6%)

法規制情報

Regulatory InformationChemical: Methanone, [4-(dodecyloxy)-2-hydroxyphenyl]phenyl-

安全データ

tsca
TSCA listed

化学と産業

用途と製造

General Manufacturing InformationMethanone, [4-(dodecyloxy)-2-hydroxyphenyl]phenyl-: ACTIVE

調製方法

製造方法Preparation by reaction of 1-bromododecane (dodecyl bromide or lauryl bromide) with resbenzophenone in the presence of potassium carbonate in refluxing acetone for 16 h or for 20 h.

純化方法Recrystallise it from n-hexane and then 10% (v/v) EtOH in acetonitrile [Valenty et al. J Am Chem Soc 106 6155 1984].

サプライヤー45 社

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
Hangzhou Collab Medicine Co.,Ltd.+86-15936229464 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
江苏能越新材料科技有限公司13376001577 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

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