HCID8391

4-Methyl-2-nitrophenol

C7H7NO3153.14 g/molCAS 119-33-5

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IDENTITY

结构与身份

标准SMILES: Cc1ccc(O)c([N+](=O)[O-])c1
InChIKey: SYDNSSSQVSOXTN-UHFFFAOYSA-N
分子式: C7H7NO3
平均分子量: 153.14 g/mol
单同位素质量: 153.04259309

COMPUTED

结构计算性质

已同步

XLogP: 2.4
极性表面积: 66.1 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 0
重原子: 11
形式电荷: 0
复杂度: 154

PROPERTIES

实验与物化性质

Vapor Pressure

0.000632 [mmHg]

Physical Description

Colorless solid; [EPA OHM/TADS] Yellow solid with a phenolic odor; mp = 32-35 deg C; [Alfa Aesar MSDS]

Kovats Retention Index

1249.8；1236.4；1241.3；1250；1260

1914；1919；1919；1922

GHS

GHS分类

GHS Classification

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (98.1%): 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+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 53 reports by companies from 7 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

Regulatory Information

Chemical: Phenol, 4-methyl-2-nitro-

Status: Active Update: 01-03-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/20348

Phenol, 4-methyl-2-nitro-: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary

Corrosive to skin and mucous membranes: May cause kidney and liver injury; [EPA OHM/TADS] A skin and strong eye irritant; Harmful by skin absorption; [Alfa Aesar MSDS] See 2-Nitrophenol.

Hazard Classes and Categories

Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (98.1%)

TOXICITY

毒理信息

Adverse Effects

Occupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.；Dermatotoxin - Skin burns.

REGULATORY

法规信息

Regulatory Information

Chemical: Phenol, 4-methyl-2-nitro-

Status: Active Update: 01-03-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/20348

Phenol, 4-methyl-2-nitro-: Does not have an individual approval but may be used under an appropriate group standard

PHARMACOLOGY

药理信息

Cellular Locations

Membrane

USES

用途与制造

General Manufacturing Information

Phenol, 4-methyl-2-nitro-: ACTIVE

ALIASES

名称与别名

共 65 条

4-Methyl-2-nitrophenol119-33-52-NITRO-P-CRESOLPhenol, 4-methyl-2-nitro-2-Nitro-4-methylphenol4-Hydroxy-3-nitrotolueneo-Nitro-p-cresol2-Nitro-4-cresolp-Cresol, 2-nitro-DTXSID0026961P92KPK2NL3NSC-5387DTXCID606961RefChem:477155204-315-64-METHYL-2-NITRO-PHENOLMFCD0000712012167-20-3Phenol, methylnitro-68137-08-6

REACTIONS