CAS 188813-04-9 3-Bromo-5-methylbenzaldehyde (HCID 16641083)

基本情報

CAS: 188813-04-9
標準SMILES: Cc1cc(Br)cc(C=O)c1
InChIKey: DMSLPBFUZSQMQT-UHFFFAOYSA-N
分子式: C8H7BrO
平均分子量: 199.04 g/mol
単同位体質量: 197.96803

名称と識別子

優先名称: 3-Bromo-5-methylbenzaldehyde
IUPAC: 3-bromo-5-methylbenzaldehyde
現地名: 3-ブロモ-5-メチルベンズアルデヒド
英語名: 3-Bromo-5-methylbenzaldehyde
分子式: C8H7BrO
分子量: 199.04

名称と別名

3-BROMO-5-METHYLBENZALDEHYDE188813-04-9DTXSID30586362RefChem:277608DTXCID80537127695-636-4Benzaldehyde, 3-bromo-5-methyl-MFCD098366803-bromo-5-methyl-benzaldehydeSCHEMBL1996468SCHEMBL30667909DMSLPBFUZSQMQT-UHFFFAOYSA-N

名称をさらに表示

3-ブロモ-5-メチルベンズアルデヒド

CL8308AKOS005068130AB53369CS-W005073GS-36843-Bromo-5-methylbenzaldehyde, AldrichCPRSY111435DB-011154

データベース識別子

CAS: 188813-04-9
PubChem CID: 16641083
DTXSID: DTXSID30586362
EC Number: 695-636-4

物性

構造計算による物性

XLogP: 2.4
極性表面積: 17.1 Å²
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: 1
重原子数: 10
形式電荷: 0
複雑度: 124

物理化学的性質

沸点: 255.6 · 255.6±20.0 °C(Predicted)
比重(密度): 1.49 · 1.490±0.06 g/cm3(Predicted)
貯蔵温度: 2 · under inert gas (nitrogen or Argon) at 2-8°C
外見: crystalline solid
色: White

化学的性質

化学的特性Pale yellow liquid

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 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 CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

安全データ

hs_code: 2913000090

化学と産業

サプライヤー98 社

常州帝通化工有限公司+86-0519-88298848 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

杭州鸿喜生物医药科技有限公司18989489206 · [email protected]

上海策嵘生物科技有限公司[email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

化合物ノート

読み込み中…