610-93-5 (6-硝基苯酞,6-Nitrophthalide)

快速询单

结构式：

6-硝基苯酞MOL文件

CAS号：

610-93-5

中文名称：

6-硝基苯酞

英文名称：

6-Nitrophthalide

分子式：

C₈H₅NO₄

分子量：

179.129602193832

6-硝基苯酞(610-93-5)名称与标识符

名称

中文别名：

6-硝基苯酞;6-硝基四氯苯酞;6-硝基-1,3-二氢异苯并呋喃-1-酮;6-硝苯酞酯;6-硝基-1(3H)-异苯并呋喃酮;

英文别名：

6-nitro-1(3H)-Isobenzofuranone;6-Nitrophthalide;6-nitro-3H-2-benzofuran-1-one;6-Nitro-3H-isobenzofuran-1-one;6-Nitroisobenzofuran-1(3H)-one;NSC 11332;6-nitro-1,3-dihydroisobenzofuran-1-one;6-Nitro-2-benzofuran-1(3H)-one;1(3H)-Isobenzofuranone, 6-nitro-;MLS002638203;RNWGZXAHUPFXLL-UHFFFAOYSA-N;6-nitro-3-hydroisobenzofuran-1-one;6-nitro-1,3-dihydro-2-benzofuran-1-one;6-nitrophtalide;6-Nitro-phthalid;NSC11332;4-Oxiranylmethylphenol;PubChem22515;Maybridge1_005101;6-Ni;BP-11369;Phthalide, 6-nitro-;SCHEMBL1684401;AKOS000278155;HMS555P19;CCG-51603;AS-5160;AM20060448;UNII-35QB7T32YC;1,3-Dihydro-6-nitrobenzo[c]furan-1-one;610-93-5;EU-0066960;EN300-108287;InChI=1/C8H5NO4/c10-8-7-3-6(9(11)12)2-1-5(7)4-13-8/h1-3H,4H;SR-01000390720-1;MFCD00033529;SY021140;SMR001547692;J-800291;SR-01000390720-2;NSC-11332;6-nitroisobenzofuran-1-(3H)-one;CHEMBL2144021;6-Nitrophthalide, 95%;J-518960;4Et2OHbicycloNo2,6diene4carboxylate;DTXSID00870684;FT-0621276;N1055;J-640455;SR-01000390720;CS-W017285;35QB7T32YC;6-Nitro-2-benzofuran-1(3H)-one #;HMS3078N11;STK865112;BBL027915;DB-023075;

标识符

MDL：

MFCD00033529

InChIKey：

RNWGZXAHUPFXLL-UHFFFAOYSA-N

Inchi：

1S/C8H5NO4/c10-8-7-3-6(9(11)12)2-1-5(7)4-13-8/h1-3H,4H2

SMILES：

O1C(C2C=C(C=CC=2C1)[N+](=O)[O-])=O

6-硝基苯酞(610-93-5)物化性质

实验特性

LogP : 1.78840
PSA : 72.12000
折射率 : 1.5160 (estimate)
沸点 : 413.4°C at 760 mmHg
熔点 : 143.0 to 147.0 deg-C
闪点 : 229.6°C
溶解度 : Very 微溶 (0.95 g/L) (25 ºC),
颜色与性状 : 淡黄色结晶粉末
密度 : 1.519±0.06 g/cm3 (20 ºC 760 Torr),

计算特性

精确分子量 : 179.02200
氢键供体数量 : 0
氢键受体数量 : 4
可旋转化学键数量 : 0
同位素质量 : 179.022
重原子数量 : 13
复杂度 : 247
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 0.6
互变异构体数量 : 无
表面电荷 : 0
拓扑分子极性表面积 : 72.1

6-硝基苯酞(610-93-5)安全信息

6-硝基苯酞(610-93-5)海关数据

海关编码：

2932209090

海关数据：

中国海关编码：

2932209090

概述：

2932209090. 其他内酯. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

申报要素：

品名, 成分含量, 用途

Summary：

2932209090. other lactones. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

6-硝基苯酞(610-93-5)推荐厂家更多厂家(29)

公司名称	手机号/电话	联系人	QQ	询单
上海腾准生物科技有限公司	19821570922 021-34053661	张经理	3003871136	询单
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上海瀚思化工有限公司	18939883912 021-34536277	顾经理	3003949364	询单
铼博（上海）生化科技有限公司	13311756052 021-60536361 13311756052 13311756131	张经理	2851717387	询单
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上海绩祥生物科技有限公司	13093077543	陆经理	3985448220	询单
南通众合化工新材料有限公司	18762756250 0513-55074056	胡经理	2369399482	询单

6-硝基苯酞(610-93-5)上下游

6-溴-2-苯并呋喃-1(3H)酮 6-氰基苯酞

6-硝基苯酞(610-93-5)相关文献

1. Enabling room-temperature reductive C–N coupling of nitroarenes: combining homogeneous and heterogeneous synergetic catalyses mediated by light
Xuexue Dong,Yiying Yang,Yang Shen,Aihua Yuan,Zengjing Guo,Heng Song,Fu Yang Green Chem. 2022 24 4012
2. Formation of some 3-aryl-3,4-dihydroisocoumarins by thermal ring closure of stilbene-2-carboxylic acids
Geoffrey C. A. Bellinger,William E. Campbell,Robin G. F. Giles,Julius D. Tobias J. Chem. Soc. Perkin Trans. 1 1982 2819
3. Indole β-nucleophilic substitution. Part 5. Synthesis of the four isomeric 5H-pyrido [x,y-b] carbazole-5,11-diones and benzo analogues
William R. Ashcroft,Lesley Dalton,Michael G. Beal,Godfred L. Humphrey,John A. Joule J. Chem. Soc. Perkin Trans. 1 1983 2409
4. 1044. Bisquaternary salts related to quinapyramine (Antrycide). Replacement of the quinoline nucleus by other heterocycles
S. S. Berg,E. W. Parnell J. Chem. Soc. 1961 5275
5. Notes
M. S. Gibson,A. H. Beckett,G. O. Jolliffe,M. Neeman,C. A. Bunton,D. N. Spatcher,C. M. Atkinson,C. W. Brown,J. C. E. Simpson,K. G. Lewis,J. I. Carasso,R. W. Pittman J. Chem. Soc. 1956 1076
6. Photoinduced intramolecular charge transfer to meta position of benzene ring in 6-aminophthalides
Jerzy Karpiuk,Yuriy N. Svartsov,Jacek Nowacki Phys. Chem. Chem. Phys. 2005 7 4070
7. A Reusable Polymer-anchored Palladium Catalyst for Reduction of Nitroorganics, Alkenes, Alkynes and Schiff Bases?
Monirul Islam,Asish Bose,Dipakranjan Mal,Chitta R. Saha J. Chem. Res. (S) 1998 44
8. Gamboge. Part IV. Scission of gambogic acid by alkali
B. J. Hunt,W. Rigby J. Chem. Soc. C 1970 2459
9. Hydrogenation of substituted phthalic anhydrides over palladium
Alan J. McAlees,Robert McCrindle,David W. Sneddon J. Chem. Soc. Perkin Trans. 1 1977 2030
10. An investigation of the Wittig reaction between a series of monosubstituted phthalic anhydrides and ethoxycarbonylmethylidenetriphenylphosphorane
Ahmad Allahdad,David W. Knight J. Chem. Soc. Perkin Trans. 1 1982 1855

6-硝基苯酞(610-93-5)参考资料

Reaxys RN：

157634

PubChem CID：

223584

6-硝基苯酞(610-93-5) MSDS

基础信息

Name:	6-Nitrophthalide 97% Material Safety Data Sheet
Synonym:
CAS:	610-93-5

Section 1 - Chemical Product ? MSDS Name:6-Nitrophthalide 97% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
610-93-5	6-Nitrophthalide	97%	unlisted

Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Not available.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation.
Ingestion:
May cause irritation of the digestive tract.
Inhalation:
May cause respiratory tract irritation.
Chronic:
Not available.

Section 4 - FIRST AID MEASURES
? Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Get medical aid. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:

Section 5 - FIRE FIGHTING MEASURES
? General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or chemical foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
? General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container.

Section 7 - HANDLING and STORAGE
? Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage:
Store in a cool, dry place. Store in a tightly closed container.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
? Engineering Controls:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 610-93-5: Personal Protective Equipment Eyes: Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
?
Physical State: Solid
Color: Not available.
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 140 - 145 deg C
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula:
Molecular Weight: 179.13

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, oxides of nitrogen, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 610-93-5 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
6-Nitrophthalide - Not listed by ACGIH, IARC, or NTP.

Section 12 - ECOLOGICAL INFORMATION
?

Section 13 - DISPOSAL CONSIDERATIONS
? Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION
?
IATA
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 610-93-5: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 610-93-5 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 610-93-5 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A