1-ヒドロキシ-2-ナフトアルデヒド

1-Hydroxy-2-naphthaldehyde

HCID 443195
ノート反応
部分構造検索類似構造を探す

基本情報

CAS
574-96-9
標準SMILES
O=Cc1ccc2ccccc2c1O
InChIKey
OITQDWKMIPXGFL-UHFFFAOYSA-N
分子式
C11H8O2
平均分子量
172.18 g/mol
単同位体質量
172.05242949

名称と識別子

優先名称
1-Hydroxy-2-naphthaldehyde
IUPAC
1-hydroxynaphthalene-2-carbaldehyde
現地名
1-ヒドロキシ-2-ナフトアルデヒド
英語名
1-HYDROXY-2-NAPHTHALDEHYDE
分子式
C11H8O2
分子量
172.18

名称と別名

1-Hydroxy-2-naphthaldehyde574-96-91-hydroxynaphthalene-2-carbaldehydeCHEBI:28091DTXSID70332062RefChem:75967DTXCID20283156679-991-21-Naphthol-2-carboxaldehydeMFCD000923251-hydroxy-2-naphtoaldehydeSCHEMBL589343
名称をさらに表示
1-ヒドロキシ-2-ナフトアルデヒドヒドロキシナフタルアルデヒド1-ヒドロキシナフタレン-2-カルバルデヒド1-ヒドロキシ-2-ナフタレンカルボアルデヒド1-ヒドロキシナフタレン-2-カルボアルデヒドHydroxynaphthaldehyde1-NAPHTHOL-2-ALDEHYDE1-Hydroxy-2-naphthaldehyde>1-HYDROXY-2-NAPHTHALDEHYDE 98+%2-Naphthalenecarboxaldehyde, 1-hydroxy-
AKOS006228781H0839EN300-194451(z)-2-(hydroxylmethylene)naphthalen-1(2h)-oneZ1201619052ACMC-209lymAC1L9E7TAC1Q78HN

データベース識別子

CAS
574-96-9
PubChem CID
443195
DTXSID
DTXSID70332062
ChEBI
CHEBI:28091
EC Number
679-991-2
Nikkaji
J2.385.173C、J534.105A

物性

構造計算による物性

XLogP
2.6
極性表面積
37.3 Ų
水素結合供与体数
1
水素結合受容体数
2
回転可能結合数
1
重原子数
13

物理化学的性質

融点
56 °C · 56°C
沸点
317 · 317.0±15.0 °C(Predicted)
比重(密度)
1.288 · 1.288±0.06 g/cm3(Predicted)
貯蔵温度
Inert atmosphere,Room Temperature
溶解性
クロロホルム（微量）、メタノール（微量）
酸解離定数(Pka)
8.37 · 8.37±0.50(Predicted)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (33.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H400 (66.7%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (33.3%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 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 (66.7%)；Eye Irrit. 2A (66.7%)；STOT SE 3 (33.3%)；Aquatic Acute 1 (66.7%)；Aquatic Chronic 1 (33.3%)

安全データ

hs_code
2912490090
risk_code
36/37/38-52
safety_code
26-36/37/39

化学と産業

応用分野 · 1 件

使用1-Hydroxy-2-naphthaldehyde is used as a reagent in the synthesis of naphthofurancarboxamides as melanin concentrating hormone receptor 1 antagonists. Also used as a reagent in the synthesis of hydropyridinylphenoxyacetohydrazones which show anticonvulsant, anti-inflammatory, and analgesic activity.

上流・下流製品情報

サプライヤー66 社

上海康恩博医药科技有限公司17510465506 · [email protected]
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海策嵘生物科技有限公司[email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

関連反応

2 件
反応記録を作成

化合物ノート

読み込み中…