4-nitrophenol
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Formula: C6H5NO3
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Molecular weight: 139.11
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Smiles: C1=CC(=CC=C1[N+](=O)[O-])O
4-nitrophenol
Names
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Mycotoxin name: 4-nitrophenol
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First synonym: 4-nitrophenol
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Synonyms: 4-Nitrophenol,p-nitrophenol,100-02-7,Phenol, 4-nitro-,Niphen,Paranitrophenol,4-Hydroxynitrobenzene,p-Hydroxynitrobenzene,Phenol, p-nitro-,para-nitrophenol,Mononitrophenol,Paranitrofenol,Paranitrofenolo,p-Nitrofenol,4-Nitrofenol,RCRA waste number U170,Caswell No. 603,NCI-C55992,p-Nitrofenol [Czech],Paranitrofenol [Dutch],4-Nitrofenol [Dutch],Paranitrofenolo [Italian],PNP,Paranitrophenol [French,German],1-Hydroxy-4-nitrobenzene,4-nitro-phenol,RCRA waste no. U170,NSC 1317,UNII-Y92ZL45L4R,UN1663,EPA Pesticide Chemical Code 056301,CHEBI:16836,AI3-04856,MFCD00007331,Y92ZL45L4R,p-Nitrophenol [UN1663] [Poison],4-Nitrophenol-15N,DSSTox_CID_1834,DSSTox_RID_76356,DSSTox_GSID_21834,CAS-100-02-7,NPO,CCRIS 2316,HSDB 1157,EINECS 202-811-7,p-nitro phenol,4-nitryl phenol,4- nitrophenol,4-nitro phenol,4-nitrophenol-,4-Nitrophenol,,3qvu,RPN,HONP,p-Nitrophenol solution,PHENOL,4-NITRO,PARA NITRO PHENOL,WLN: WNR DQ,bmse000223,Epitope ID:161303,O2NC6H4OH,EC 202-811-7,SCHEMBL1839,4-NITROPHENOL IMP F,CHEMBL14130,PARAGOS 330264,SGCUT00249,SR-1C2,1-HYDROXY-4-NITROBENZOL,4-Nitrophenol solution, 10 mM,4-Nitrophenol, puriss., 99%,DTXSID0021834,H-M-FLUORO-D-PHE-OMEHCL,SCHEMBL13906248,SCHEMBL14501907,BDBM31678,TIMTEC-BB SBB040875,NSC1317,4-Nitrophenol, Reference Material,LABOTEST-BB LTBB002356,NSC-1317,to_000002,AKOS BBS-00004351,Tox21_202444,Tox21_300117,4-Nitrophenol, reagent grade, 98%,s6196,SBB040875,STL281865,ZINC34828682,AKOS000118985,4-Nitrophenol, spectrophotometric grade,AS00220,DB04417,MCULE-5860903209,NCGC00247904-01,NCGC00247904-02,NCGC00254220-01,NCGC00259993-01,4-Nitrophenol 100 microg/mL in Methanol,4-Nitrophenol, ReagentPlus(R), >=99%,AS-13146,BP-20405,H447,4-Nitrophenol 10 microg/mL in Acetonitrile,DS-005476,FT-0600022,FT-0672814,N0161,N0162,N0220,ST50214472,1986-EP2275404A1,1986-EP2280282A1,1986-EP2289887A2,1986-EP2289888A2,1986-EP2298776A1,1986-EP2301536A1,1986-EP2301538A1,1986-EP2302382A2,1986-EP2302383A2,1986-EP2305825A1,1986-EP2311455A1,1986-EP2314586A1,4-Nitrophenol, JIS special grade, >=99.0%,C00870,N-3600,N-3610,47175-EP2281563A1,47175-EP2298312A1,47175-EP2308833A2,47175-EP2311822A1,197894-EP2269975A2,197894-EP2269997A2,197894-EP2275415A2,4-Nitrophenol, PESTANAL(R), analytical standard,A800004,AE-562/40217722,Q656269,Z57127483,F9995-1636,4-Nitrophenol, certified reference material, TraceCERT(R),UNII-UV7XKM40LO component BTJIUGUIPKRLHP-UHFFFAOYSA-N,4-Nitrophenol solution, stock solution, for mass spectrometry,4-Nitrophenol solution, working solution, for mass spectrometry,4-Nitrophenol solution, certified reference material, 5000 mug/mL in methanol,Acetaminophen Related Compound F, United States Pharmacopeia (USP) Reference Standard,4-NITROPHENOL (Acetaminophen Related Compound F)(Paracetamol Impurity F), Pharmaceutical Secondary Standard; Certified Reference Material
Identifiers / External links
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CAS: 100-02-7
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PubChem CID: 980
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DSS TOX CID: DTXCID201834
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ChemSpiderID: 955
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ChEMBL: CHEMBL14501907,CHEMBL14130,CHEMBL13906248,CHEMBL1839
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US FDA (UNII): UNII-Y92ZL45L4R,UNII-UV7XKM40LO
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Wikidata (wiki): Q656269
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Chemical Entities of Biological Interest (CHEBI): CHEBI:39362,CHEBI:16836
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CompTox Chemicals Dashboard (DTXSID): DTXSID0021834
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TOX21 samples 2:Tox21_202444,Tox21_300117
Structure
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Smiles: C1=CC(=CC=C1[N+](=O)[O-])O
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Isomeric smiles: C1=CC(=CC=C1[N+](=O)[O-])O
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Inchi: InChI=1S/C6H5NO3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H
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Inchikey: BTJIUGUIPKRLHP-UHFFFAOYSA-N
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2D structure:
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3D structure:
Physico-chemical properties
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Formula: C6H5NO3
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Molecular weight: 139.11
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Monoisotopic mass: 139.026943022
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Fungi
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Fungi id Species 638 Monascus purpureus BCRC 38113