2-エトキシ-1-ナフトエ酸

2-Ethoxy-1-naphthoic acid

HCID 75210CAS 2224-00-2
部分構造検索類似構造を探す

基本情報

標準SMILES
CCOc1ccc2ccccc2c1C(=O)O
InChIKey
MYFBSSDLYGWAHH-UHFFFAOYSA-N
分子式
C13H12O3
平均分子量
216.23 g/mol
単同位体質量
216.07864424

名称と識別子

優先名称
2-Ethoxy-1-naphthoic acid
IUPAC
2-ethoxynaphthalene-1-carboxylic acid
現地名
2-エトキシ-1-ナフトエ酸
英語名
2-ETHOXY-1-NAPHTHOIC ACID
分子式
C13H12O3
分子量
216.23

名称と別名

2-Ethoxy-1-naphthoic acid2224-00-21-Naphthalenecarboxylic acid, 2-ethoxy-EINECS 218-745-7DTXSID9062277RefChem:471401DTXCID4036649218-745-72-ethoxynaphthalene-1-carboxylic acid2-ethoxynaphthoic acidMFCD000040082-ethoxynaphthalenecarboxylic acid
名称をさらに表示
2-エトキシ-1-ナフトエ酸2-エトキシナフタレン-1-カルボン酸2-エトキシ-1-ナフタレンカルボン酸2エトキシ1ナフトエ酸RARECHEM AL BE 05662-Ethoxy-1-phthoic acid2-ETHOXYNAPHTOIC ACID, 98%2-Ethoxynaphthoic acid,98%2-Ethoxy-1-naphthoic acid, tech.Nafcillin 2-Ethoxynaphthoic Acid2-ethoxy-1-naphthalenecarboxylate
timtec-bb sbb0057712-Ethoxy-1-naphthoic Acid; 2-Ethoxy-1-naphthalenecarboxylic Acid2-ethoxy-1-naphthalenecarboxylic acid2-ethyloxy-1-naphthalenecarboxylic acidB8FF3KQ7VSSCHEMBL503962SCHEMBL303930292-Ethoxy-1-naphthoic acid, 97%

データベース識別子

CAS
2224-00-2
PubChem CID
75210
DTXSID
DTXSID9062277
UNII
B8FF3KQ7VS
EC Number
218-745-7
Nikkaji
J299.182I

物性

構造計算による物性

XLogP
3
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
3
重原子数
16

物理化学的性質

融点
141 · 141-145 °C
沸点
316.65 °C · 316.65°C (rough estimate)
比重(密度)
1.1652 · 1.1652 (rough estimate)
屈折率
1.509 · 1.5090 (estimate)
溶解性
メタノール
外見
結晶性粉末

化学的性質

化学的特性white to pale brown crystalline powder

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (12.5%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (75%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (87.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (62.5%): 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 8 reports by companies from 5 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 (75%)；Eye Irrit. 2 (87.5%)；STOT SE 3 (62.5%)

安全データ

tsca
TSCA listed
hs_code
38220090
risk_code
36/37/38
hazard_code
Xi
safety_code
24/25-36-26

化学と産業

用途と製造

General Manufacturing Information1-Naphthalenecarboxylic acid, 2-ethoxy-: INACTIVE

応用分野

使用2-Ethoxynaphthalene-1-carboxylic Acid is used in the synthesis of various antistaphylococcic penicillins.

上流・下流製品情報

サプライヤー50 社

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
武汉灵灵九生物科技有限公司15623309010
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

関連反応

11 件
反応記録を作成

関連ノート

読み込み中…