HCID11805727

1-Acetoxy-2-methylnaphthalene

(2-methylnaphthalen-1-yl) acetate

C13H12O2200.23 g/molCAS 5697-02-9

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: CC(=O)Oc1c(C)ccc2ccccc12
InChIKey: WVOAPRDRMLHUMI-UHFFFAOYSA-N
分子式: C13H12O2
平均分子量: 200.23 g/mol
单同位素质量: 200.08372962

COMPUTED

结构计算性质

已同步

XLogP: 3.3
极性表面积: 26.3 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 2
重原子: 15
形式电荷: 0
复杂度: 237

GHS

GHS分类

来源：PubChem

GHS Classification

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger 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+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 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.

HAZARDS

危害信息

来源：PubChem

Regulatory Information

Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/3870

Hazard Classes and Categories

Skin Sens. 1 (100%)；Aquatic Chronic 2 (100%)

Skin Irrit. 2 (100%)；Eye Dam. 1 (100%)；STOT SE 3 (100%)

REGULATORY

法规信息

来源：PubChem

Regulatory Information

Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/3870

USES

用途与制造

来源：PubChem

Household Products

Information on 24 consumer products that contain 1-Acetoxy-2-Methylnaphthalene in the following categories is provided:；• Personal Care

ALIASES

名称与别名

共 34 条

2-Methyl-1-naphthyl Acetate1-Acetoxy-2-methylnaphthalene5697-02-9(2-methylnaphthalen-1-yl) Acetate1-Naphthalenol, 2-methyl-, acetate1-Naphthol, 2-methyl-, acetate6I1S02A5B92-METHYL-1-NAPHTHOL ACETATE1-Naphthalenol, 2-methyl-, 1-acetate1-Acetoxy-2-methylnaphthalene [INCI]DTXSID30205546RefChem:428954DTXCID60128037454-690-71-Acetoxy-2-met hoxynaphthalene2-METHYLNAPHTHALEN-1-YL ACETATEMFCD09038535UNII-6I1S02A5B9(2-methyl-1-naphthyl) acetateAcetic Acid 2-Methyl-1-naphthyl Ester

REACTIONS

参与反应

3 条

uspto-grants-1996_06 · 10.6084/m9.figshare.5104873.v1 · US05529583

查看

uspto-grants-2000_04 · 10.6084/m9.figshare.5104873.v1 · US06045590

查看

uspto-grants-1997_09 · 10.6084/m9.figshare.5104873.v1 · US05672180

查看