4-Methoxyphenoxyacetic acid 分子结构式
HCID74649

4-Methoxyphenoxyacetic acid

2-(4-methoxyphenoxy)acetic acid

C9H10O4182.17 g/molCAS 1877-75-4

IDENTITY

结构与身份

标准SMILES
COc1ccc(OCC(=O)O)cc1
InChIKey
BHFSBJHPPFJCOS-UHFFFAOYSA-N
分子式
C9H10O4
平均分子量
182.17 g/mol
单同位素质量
182.0579088

COMPUTED

结构计算性质

已同步
XLogP
1.2
极性表面积
55.8 Ų
氢键供体
1
氢键受体
4
可旋转键
4
重原子
13
形式电荷
0
复杂度
161

GHS

GHS分类

来源:PubChem
GHS Classification

Warning

H302 (87%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (15.2%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (15.2%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (13%): 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 46 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.

HAZARDS

危害信息

来源:PubChem
Hazard Classes and Categories

Acute Tox. 4 (87%);Skin Irrit. 2 (15.2%);Eye Irrit. 2 (15.2%);STOT SE 3 (13%)

USES

用途与制造

来源:PubChem
General Manufacturing Information

Acetic acid, 2-(4-methoxyphenoxy)-: INACTIVE

ALIASES

名称与别名

共 52 条
2-(4-Methoxyphenoxy)acetic acid1877-75-44-Methoxyphenoxyacetic acidAcetic acid, (4-methoxyphenoxy)-(p-Methoxyphenoxy)acetic acidNSC 4255EINECS 217-513-2NSC 45652Acetic acid, 2-(4-methoxyphenoxy)-AI3-10592DTXSID2062030RefChem:99662DTXCID3035921BHFSBJHPPFJCOS-UHFFFAOYSA-N(4-Methoxyphenoxy)acetic acidP-methoxyphenoxyacetic acidAcetic acid, (p-methoxyphenoxy)-MFCD00014360Cambridge id 5163559TimTec1_002918

REACTIONS

参与反应

43
HRID 33042 反应方程式

uspto-grants-2008_09 · 10.6084/m9.figshare.5104873.v1 · US07427613B2

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HRID 718236 反应方程式

uspto-grants-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09193741B2

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HRID 718271 反应方程式

uspto-grants-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09193741B2

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HRID 718273 反应方程式

uspto-grants-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09193741B2

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HRID 718275 反应方程式

uspto-grants-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09193741B2

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HRID 718278 反应方程式

uspto-grants-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09193741B2

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HRID 718279 反应方程式

uspto-grants-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09193741B2

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HRID 718295 反应方程式

uspto-grants-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09193741B2

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