2,6-Naphthalenedicarboxylic acid 分子结构式
HCID14357

2,6-Naphthalenedicarboxylic acid

naphthalene-2,6-dicarboxylic acid

C12H8O4216.19 g/molCAS 1141-38-4

IDENTITY

结构与身份

标准SMILES
O=C(O)c1ccc2cc(C(=O)O)ccc2c1
InChIKey
RXOHFPCZGPKIRD-UHFFFAOYSA-N
分子式
C12H8O4
平均分子量
216.19 g/mol
单同位素质量
216.04225873

COMPUTED

结构计算性质

已同步
XLogP
2.8
极性表面积
74.6 Ų
氢键供体
2
氢键受体
4
可旋转键
2
重原子
16
形式电荷
0
复杂度
269

PROPERTIES

实验与物化性质

来源:PubChem
Physical Description

Dry Powder

GHS

GHS分类

来源:PubChem
GHS Classification

This chemical does not meet GHS hazard criteria for 83.3% (15 of 18) of all reports.

Warning

H315 (16.7%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (16.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 18 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 15 of 18 reports by companies.;There are 2 notifications provided by 3 of 18 reports by companies with hazard statement code(s).;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

Chemical: 2,6-Naphthalenedicarboxylic acid;Specific Information Requirement: Obligations to provide information apply. You must tell us within 28 days if the circumstances of your importation or manufacture (introduction) are different to those in our assessment.

2,6-Naphthalenedicarboxylic acid is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2,6-Naphthalenedicarboxylic acid are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 12-01-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/26701

2,6-Naphthalenedicarboxylic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and Categories

Skin Irrit. 2 (16.7%);Eye Irrit. 2A (16.7%)

REGULATORY

法规信息

来源:PubChem
Regulatory Information

Chemical: 2,6-Naphthalenedicarboxylic acid;Specific Information Requirement: Obligations to provide information apply. You must tell us within 28 days if the circumstances of your importation or manufacture (introduction) are different to those in our assessment.

2,6-Naphthalenedicarboxylic acid is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2,6-Naphthalenedicarboxylic acid are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 12-01-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/26701

2,6-Naphthalenedicarboxylic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

USES

用途与制造

来源:PubChem
U.S. Production

2023: <75,000 lb;2022: 500,000 - <1,000,000 lb;2021: 500,000 - <1,000,000 lb;2020: 500,000 - <1,000,000 lb

Consumer Uses

Monomers

Industry Uses

Monomers

General Manufacturing Information

Plastics Material and Resin Manufacturing

2,6-Naphthalenedicarboxylic acid: ACTIVE

ALIASES

名称与别名

共 56 条
2,6-Naphthalenedicarboxylic acid1141-38-4naphthalene-2,6-dicarboxylic acid2,6-NAPHTHALIC ACID2,6-DICARBOXYNAPHTHALENEDTXSID5029211K3C4DYZ29ODTXCID009211CHEBI:44460RefChem:445809214-527-0MFCD000041052,6-naphthalene-dicarboxylic acidNSC-964102,6-Naphthalic Acid||||NSC 964102,6-naphthalene dicarboxylic acidEINECS 214-527-0NSC 96410UNII-K3C4DYZ29O2,6-napthalenedicarboxylic acid

REACTIONS

参与反应

32
HRID 2379 反应方程式

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05728870

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HRID 2380 反应方程式

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05728870

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HRID 35032 反应方程式

uspto-grants-1988_08 · 10.6084/m9.figshare.5104873.v1 · US04764638

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HRID 139179 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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HRID 175625 反应方程式

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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HRID 343732 反应方程式

uspto-grants-1999_01 · 10.6084/m9.figshare.5104873.v1 · US05862796

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HRID 864683 反应方程式

uspto-grants-1996_10 · 10.6084/m9.figshare.5104873.v1 · US05563294

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HRID 864684 反应方程式

uspto-grants-1996_10 · 10.6084/m9.figshare.5104873.v1 · US05563294

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