4-Nitrophenol 4-硝基苯酚

CAS 100-02-7 MFCD00007331

化学结构图

100-02-7
SMILES: O=[N+]([O-])c1ccc(O)cc1

化学属性

Mol. FormulaC6H5NO3
Mol. Weight139
Boiling Point279°C
Melting Point112°C
Density1.481
Flash Point169°(336°F)
Solubility溶于热水、醇、醚。
TSCAYes
Autoignition Point541 °F
Vapor Pressure0.6 mmHg ( 120 °C)
Stability对光敏感
Danger-Level-
pH-:-
Redox-

别名和识别编码

Chemical Name4-Nitrophenol
CAS Number100-02-7
Synonym p-Nitrophenol (a-Form, stabil) Niphen PARA-NITROPHENOL 对-硝基苯酚 NCI-C55992 Paranitrofenol 1-hydroxy-4-nitrobenzene 4-HYDROXYNITROBENZENE p-nitrophenol 4-硝基苯酚 P-NITROPHENOL ACETAMINOPHEN IMPURITY F p-Hydroxynitrobenzene 4-NITROHYDROXYBENZENE RCRA waste number U170 4-hydroxynitrobenzene 對硝基酚 phenol, 4-nitro- Phenol, p-nitro- 对硝基酚 P-NITROPHENOL 硝基酚 1-Hydroxy-4-nitrobenzol 4-nitrophenol 对硝基苯酚;对硝基酚;4-硝基酚 Phenol, p-nitro- 4-Nitrofenol 4-硝基酚,4-硝基苯酚 p-Nitrophenol (α-Form, stabil) p-nitrophenole p-Nitrophenol (ß-Form, instabil) AKOS BBS-00004351 4-hydroxy-1-nitrobenzene 1-Hydroxy-4-nitrobenzene Mononitrophenol 4-硝基酚 对硝基苯酚; 对硝基酚; 4-硝基酚; 4-硝基苯酚 对硝基苯酚 对硝基苯酚 溶液 p-Nitrophenol (β-Form, instabil) 4-硝基-1-羟基苯 4-nitro-phenol Paranitrophenol 对硝基酚 p-hydroxynitrobenzene 对硝基苯酚; ACETAMINOPHENE IMP F p-Nitrophenol 4-Nitrophenol p-Nitrofenol p-Nitrophenol; 1-Hydroxy-4-nitrobenzene 4-nitro-pheno Phenol,4-nitro- Paranitrofenolo HONP 4-Hydroxynitrobenzene NSC 1317 4-硝基苯酚 溶液
PubChem Substance ID980
EC Number202-811-7
Beilstein Registry Number6,226
MDL NumberMFCD00007331
Merck Number6620
Chemical Name Translation4-硝基苯酚
Reaxys-RN1281877
Wiswesser Line NotationWNR DQ
LabNetwork Molecule IDLN00195731
InChIInChI=1S/C6H5NO3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H
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分类

  • {Chemicalbook} 农药中间体: 杀虫剂中间体: 苯甲
  • {SA} Alpha sort, Alphabetic, Analytical Standards, Analytical/Chromatography, Bioactive Small Molecules, Cell Biology, Chromatography, Environmental Standards, Metabolites, N, N-P, NA - NI, Parathion metabolites, Pesticides & Metabolites
  • {SNA} Alphabetical Index of Analytical Standards, All alphabetically sorted, Analytical Standards,
  • Activity, Bioactive Small Molecules, Biochemicals and Reagents, Cell Biology, Chromogenic, Enzyme Substrates, Enzymes, Inhibitors, and Substrates, N
  • {SNA} Activity, Chromoge

产品应用

  • 酸碱指示剂,pH5.6(无色)-7.6(黄色),有机合成。

相关文献及参考

  • Forms active esters with N-protected amino acids, useful in peptide synthesis; see, for example: J. Org. Chem., 62, 1356 (1997). For peptide reagents, see Appendix 6.
  • Merck:14,6621
  • Short: II/27B
  • Merck:14,6621 Beilstein:6,226
  • Acid-base indicator: pH 5.6 - 7.6.
  • Suzuki-type coupling of the triflate with various arylboronic acids gives biaryl derivatives: Tetrahedron, 45, 6679 (1984). For an example of Stille coupling of the triflate with an arylstannane, catalyzed by trans-Dichlorobis(triphenyl­phosphine)­palladium(II)­, 10491, see: Org. Synth. Coll., 9, 553 (1998).

安全信息

GHS Symbol
WGK Germanynwg
Hazard statements
  • H332 Harmful if inhaled 吸入有害
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
  • H373 May causes damage to organs through prolonged or repeated exposure 长期或频繁接触可能会损伤器官
Personal Protective Equipment Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US) Eyeshields, Gloves, half-mask respirator (EU), half-mask respirator (US), multi-purpose combination respirator cartridge (US) dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Hazard Codes Xn F,T Xn,T,F
RTECSSM2275000
Precautionary statements
Signal word
Safety Statements
  • S28 After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 皮肤接触后,立即用大量…(由生产厂家指定)冲洗;
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套;
  • S7 Keep container tightly closed 保存在严格密闭容器中;
  • S16 Keep away from sources of ignition - No smoking 远离火源,禁止吸烟;
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
  • R33 Danger of cumulative effects 有累积作用的危险
  • R23/24/25 Toxic by inhalation, in contact with skin and if swallowed 吸入,皮肤接触及吞食都有毒
  • R39/23/24/25 Toxic: danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed 毒性:吸入,皮肤接触和吞食都会产生十分严重的不可逆危险
  • R11 Highly flammable 非常易燃
UN Number UN 1663 6.1/PG 3 1663 UN1663
Storage condition Light Sensitive Store in dark! 密封保存。 密封保存 储存温度2-8℃
Packing GroupIII
Hazard Class6.1
Warnings 危化品目录(2015)
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intracerebral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 90 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   PCBPBS Pesticide Biochemistry and Physiology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802)  V.1-    1971-  Volume(issue)/page/year:
   8,302,1978

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED

{haz

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intramuscular
SPECIES OBSERVED        : Bird - pigeon
DOSE/DURATION           : 65 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 49,187,1933

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Mammal - species unspecified
DOSE/DURATION           : 175 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 39(11),13,1974

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1024 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for

TYPE OF TEST            : DNA adduct
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 50 umol/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 89,95,1981

TYPE OF TEST            : Gene conversion and mitotic recombination
TEST SYSTEM             : Yeast - Saccharomyces cerevisiae
DOSE/DURATION           : 21 mmol/L
REFERENCE :
   IARCCD IARC Scientific Publications.  (Geneva, Switzerland)  No.1-26,
   1971-78.  For publisher information, see IAPUDO.  Volume(issue)/page/year:
   10,161,1974

TYPE OF TEST            : DNA repair
TEST SYSTEM             : Microorganism - not otherwise specified
DOSE/DURATION           : 10 mg/plate
REFERENCE :
   BIZNAT Biologisches Zentralblatt.  (VEB Georg Thieme, Postfach 946, Leipzig
   DDR-7010, Ger. Dem. Rep.) V.1-    1881-  Volume(issue)/page/year:
   95,463,1976

TYPE OF TEST            : DNA damage
TEST SYSTEM             : Rodent - rat Liver
DOSE/DURATION           : 700 umol/L
REFERENCE :
   EMMUEG Environmental and Molecular Mutagenesis.  (Alan R. Liss, Inc., 41 E.
   11th St., New York, NY 10003)  V.10-    1987-  Volume(issue)/page/year:
   24,181,1994

TYPE OF TEST            : DNA repair
TEST SYSTEM             : Bacteria - Bacillus subtilis
DOSE/DURATION           : 500 ug/disc
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 170,11,1986

Restrict 易制爆

其他信息

  • 方法三:由对硝基氯苯经水解、酸化而得。将浓度为137-140g/L的氢氧化钠溶液2320-2370L加入水解锅中,再加入600kg熔融的对硝基氯苯。加热至152℃,锅内压力为0.4MPa,然后停止加热,水解反应放热使温度和压力自然上升至165℃、约0.6MPa。保持3h后取样检查反应终点,反应结束后将水解物冷至120℃。将600L水和50L浓硫酸加到结晶锅中,压入上述水解物,并冷却到50℃左右,加入浓硫酸使刚果红试纸呈紫色,继续冷至30℃,抽滤,离心甩水,得含量90%以上的对硝基酚约500kg,收率92%。另一种制备法是将对硝基氯苯与氢氧化钾在氨中于75℃加热3h,反应后用盐酸酸化,即得对硝基酚。
  • Acros Organics:对硝基苯酚 4-Nitrophenol, 9
  • 用途六:用作农药、医药、染料等精细化学品的中间体。用于制造非那西丁、扑热息痛、农药1605、显影剂米妥尔、硫化草绿GN、硫化还原黑CL、硫化还原黑CLB、硫化还原蓝RNX、硫化红棕B3R。也用作皮革防霉剂以及酸值指示剂。
  • Alfa Aesar:4-硝基苯酚,99
  • 用途九:用于染料制造,药物制造及用作试剂。
  • 用途七:酸碱指示剂
  • 方法二:将含量为14%的NaOH水溶液2.5L加入反应釜中,再加入600kg对硝基氯苯,在搅拌下加热熔解,然后封闭反应釜,升温至152℃,压力0.4 MPa,停止加热,在160℃,0.6MPa下保温3h。冷却降温至120℃,将600L水和50L浓硫酸加到结晶釜中,压入上述水解物(对硝基酚钠粗品),搅拌降温至30
  • 下游产品:4-氨基苯酚 --> 2-硝基苯酚 --> 4-硝基苯
  • {Ch
  • 方法三:由对硝基氯苯经水解、酸化而得。将
  • 类别:有毒物品
  • 方法一:制备方法为对硝基氯苯水解酸化得到对硝基苯酚。 将浓度为 137~140 g/L 的氢氧化钠溶液加入水解釜中,再加入熔融的对硝基氯苯。加热至 152℃,釜内压力为 0.4 MPa,然后停止加热,水解反应放热使温度和压力自然上升到165℃,约 0.6 MPa。保持 3h 后取样检查反应终点,反应结束后将水解产物冷至 120℃。将该水解产物和一定量的浓硫酸及水加入结晶釜内,并冷却到 50℃ 左右。再加浓硫酸使刚果红试纸呈紫色,继续冷至 30℃,抽滤,离心除水,即得到含量为 90%以上的对硝基苯酚。
  • 上游原料:氢氧化钠 --> 硫酸 --> Α
  • 急性毒性:口服-大鼠 LD50: 250 毫克/公斤; 口服-小鼠 LD50: 380 毫克/公斤
  • 灭火剂:二氧化碳、砂土、泡沫、水
  • MSDS 信息:对硝基苯酚(100-02-7).msds
  • 4-硝基苯酚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 80093416 4-硝基酚;对硝基苯酚 100g 31.9元 2011/08/23 80093426 4-硝基酚;对硝基苯酚 100g 29元 2011/04/16 N0220 4-硝基苯酚 4-Nitrophenol 25G 128元
  • 蒸气压:0.6 mm Hg ( 120 °C)
  • 用途四:用作皮革防腐剂。
  • 可燃性危险特性:遇明火、高温、氧化剂可燃;高热分解有毒氮氧化物烟雾
  • 储运特性:库房通风低温干燥; 与氧化剂和食品添加剂分开存放
  • TCI Shanghai:对硝基苯酚(0.25%的水溶液)[用于pH值检测] 4-Nitrophenol (0.25% in Water) [for pH Determination](100-02-7)
  • 敏感性:Light Sensitive
  • 上游原料:氢氧化钠 -->
  • 图谱信息:4-硝基苯酚(100-02-7)红外图谱(IR2) 4-硝基苯酚(100-02-7)Raman光谱 4-硝基苯酚(100-02-7)核磁图( 1 HNMR) 4-硝基苯酚(100-02-7)质谱(MS) 4-硝基

系列性分类