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Search results for: '574-84-5'
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Fraxetin
Formula: C10H8O5Molecular weight: 208.17Synonyms: Fraxetin|574-84-5|7,8-Dihydroxy-6-methoxycoumarin|7,8-Dihydroxy-6-methoxy-2H-chromen-2-one|7,8-dihyd...SMILES: COC1=C(C(=C2C(=C1)C=CC(=O)O2)O)OInChIKey: HAVWRBANWNTOJX-UHFFFAOYSA-NInChI: InChI=1S/C10H8O5/c1-14-6-4-5-2-3-7(11)15-10(5)9(13)8(6)12/h2-4,12-13H,1H3
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4-Cyano-4'-dodecylbiphenyl
Cas Number: 57125-49-2Formula: C25H33NMolecular weight: 347.55Synonyms: DTXSID00886220 | 4'-DODECYL-[1,1'-BIPHENYL]-4-CARBONITRILE | 4-Cyano-4'-dodecylbiphenyl | 12CB | A92...SMILES: CCCCCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#NInChIKey: YTXPODSLSFRTBJ-UHFFFAOYSA-NInChI: InChI=1S/C25H33N/c1-2-3-4-5-6-7-8-9-10-11-12-22-13-17-24(18-14-22)25-19-15-23(21-26)16-20-25/h13-20H,2-12H2,1H3
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2-Methyl-2,4-pentanediol
Formula: C6H14O2Molecular weight: 118.17Synonyms: Hexylene glycol|2-METHYL-2,4-PENTANEDIOL|107-41-5|2-Methylpentane-2,4-diol|Diolane|Pinakon|2,4-Penta...SMILES: CC(CC(C)(C)O)OInChIKey: SVTBMSDMJJWYQN-UHFFFAOYSA-NInChI: InChI=1S/C6H14O2/c1-5(7)4-6(2,3)8/h5,7-8H,4H2,1-3H3
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2-(5-tert-Butyl-2-hydroxyphenyl)benzotriazole
Cas Number: 3147-76-0Formula: C16H17N3OMolecular weight: 267.33Synonyms: UV-PS | 2-(2-hydroxy-5-tert-butylphenyl)-2H-benzotriazole | Phenol, 2-(2H-benzotriazol-2-yl)-4-(1,1-...SMILES: CC(C)(C)C1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2InChIKey: WXHVQMGINBSVAY-UHFFFAOYSA-NInChI: InChI=1S/C16H17N3O/c1-16(2,3)11-8-9-15(20)14(10-11)19-17-12-6-4-5-7-13(12)18-19/h4-10,20H,1-3H3
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Cefoxitin Sodium Salt, Bacterial penicillin-binding protein inhibitor
Cas Number: 33564-30-6Formula: C16H16N3NaO7S2Molecular weight: 449.43Synonyms: sodium (6R,7S)-3-[(carbamoyloxy)methyl]-7-methoxy-8-oxo-7-[2-(thiophen-2-yl)acetamido]-5-thia-1-azab...SMILES: COC1(C2N(C1=O)C(=C(CS2)COC(=O)N)C(=O)[O-])NC(=O)CC3=CC=CS3.[Na+]InChIKey: GNWUOVJNSFPWDD-XMZRARIVSA-MInChI: InChI=1S/C16H17N3O7S2.Na/c1-25-16(18-10(20)5-9-3-2-4-27-9)13(23)19-11(12(21)22)8(6-26-15(17)24)7-28-14(16)19;/h2-4,14H,5-7H2,1H3,(H2,17,24)(H,18,20)(H,21,22);/q;+1/p-1/t14-,16+;/m1./s1
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5,5'-Dimethyl-2,2'-bipiperidine (mixture of isomers)
Cas Number: 1378805-84-5Formula: C12H24N2Molecular weight: 196.34Synonyms: 1378805-84-5 | MFCD20670944 | D4444 | D90289 | 5-methyl-2-(5-methylpiperidin-2-yl)piperidine | 5,5'-...SMILES: CC1CCC(NC1)C2CCC(CN2)CInChIKey: DSNPTGKSOFYOOS-UHFFFAOYSA-NInChI: InChI=1S/C12H24N2/c1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12/h9-14H,3-8H2,1-2H3
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5-[4-(trifluoromethyl)phenyl]morpholin-3-one
Cas Number: 1391087-84-5Formula: C11H10NO2F3Molecular weight: 245.2Synonyms: 5-[4-(trifluoromethyl)phenyl]morpholin-3-one | 1391087-84-5 | PB40338 | PB40340 | PB40506 | CS-03095...SMILES: C1C(NC(=O)CO1)C2=CC=C(C=C2)C(F)(F)FInChIKey: XEWLUIUJLIBKQK-UHFFFAOYSA-NInChI: InChI=1S/C11H10F3NO2/c12-11(13,14)8-3-1-7(2-4-8)9-5-17-6-10(16)15-9/h1-4,9H,5-6H2,(H,15,16)
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trans-2-fluorocyclopropanecarbonitrile
Cas Number: 1706444-84-9Formula: C4H4NFMolecular weight: 85.08Synonyms: cis-2-Fluorocyclopropanecarbonitrile | 1706444-84-9 | 1706463-43-5 | (1S,2S)-2-fluorocyclopropane-1-...SMILES: C1C(C1F)C#NInChIKey: KWUDEALSRGHQIP-IMJSIDKUSA-NInChI: InChI=1S/C4H4FN/c5-4-1-3(4)2-6/h3-4H,1H2/t3-,4-/m0/s1
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cis-2-fluorocyclopropanecarbonitrile
Cas Number: 1706463-43-5Formula: C4H4NFMolecular weight: 85.08Synonyms: 2-fluorocyclopropane-1-carbonitrile | cis-2-Fluorocyclopropanecarbonitrile | 1706463-43-5 | 1706444-...SMILES: C1C(C1F)C#NInChIKey: KWUDEALSRGHQIP-UHFFFAOYSA-NInChI: InChI=1S/C4H4FN/c5-4-1-3(4)2-6/h3-4H,1H2
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4-chloro-5-methyl-2,3-dihydropyridazin-3-one
Cas Number: 1638764-84-7Formula: C5H5ClN2OMolecular weight: 144.56Synonyms: 4-chloro-5-methyl-2,3-dihydropyridazin-3-one | 1638764-84-7 | SCHEMBL3424732 | SB15351 | F86001SMILES: CC1=C(C(=O)NN=C1)ClInChIKey: XIMMODMUMQZVGP-UHFFFAOYSA-NInChI: InChI=1S/C5H5ClN2O/c1-3-2-7-8-5(9)4(3)6/h2H,1H3,(H,8,9)
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7-Methoxy-1-methylisoquinoline
Cas Number: 76143-84-5Formula: C11H11NOMolecular weight: 173.21Synonyms: 7-Methoxy-1-methylisoquinoline|76143-84-5|SCHEMBL129972|DTXSID90579811|TWFJNUYBPIJQJR-UHFFFAOYSA-N|B...SMILES: CC1=NC=CC2=C1C=C(C=C2)OCInChIKey: TWFJNUYBPIJQJR-UHFFFAOYSA-NInChI: InChI=1S/C11H11NO/c1-8-11-7-10(13-2)4-3-9(11)5-6-12-8/h3-7H,1-2H3
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tert-butyl 5-cyano-2-azabicyclo[3.1.1]heptane-2-carboxylate
Cas Number: 1882055-84-6Formula: C12H18N2O2Molecular weight: 222.28Synonyms: F89551 | TERT-BUTYL 5-CYANO-2-AZABICYCLO[3.1.1]HEPTANE-2-CARBOXYLATE | 1882055-84-6SMILES: CC(C)(C)OC(=O)N1CCC2(CC1C2)C#NInChIKey: LHIFYMJGTLKCQH-UHFFFAOYSA-NInChI: InChI=1S/C12H18N2O2/c1-11(2,3)16-10(15)14-5-4-12(8-13)6-9(14)7-12/h9H,4-7H2,1-3H3
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1,3-dimethyl-5-nitro-indazole
Cas Number: 5757-84-6Formula: C9H9N3O2Molecular weight: 191.19Synonyms: 1,3-dimethyl-5-nitro-1h-indazole | 5757-84-6 | 1H-Indazole,1,3-dimethyl-5-nitro- | 1,3-dimethyl-5-ni...SMILES: CC1=NN(C2=C1C=C(C=C2)[N+](=O)[O-])CInChIKey: IPJSJINXKBSNSI-UHFFFAOYSA-NInChI: InChI=1S/C9H9N3O2/c1-6-8-5-7(12(13)14)3-4-9(8)11(2)10-6/h3-5H,1-2H3
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5-(2,2,2-trifluoroethoxy)pyridine-3-carbonitrile
Cas Number: 1211581-84-8Formula: C8H5N2OF3Molecular weight: 202.13Synonyms: 1211581-84-8 | 5-(2,2,2-trifluoroethoxy)pyridine-3-carbonitrile | 5-(2,2,2-Trifluoroethoxy)nicotinon...SMILES: C1=C(C=NC=C1OCC(F)(F)F)C#NInChIKey: CWWCKHDZNHSFOB-UHFFFAOYSA-NInChI: InChI=1S/C8H5F3N2O/c9-8(10,11)5-14-7-1-6(2-12)3-13-4-7/h1,3-4H,5H2
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5-Bromopyridine-2,4-diamine
Cas Number: 1201784-84-0Formula: C5H6BrN3Molecular weight: 188.03Synonyms: 5-bromopyridine-2,4-diamine|1201784-84-0|2,4-Pyridinediamine, 5-bromo-|5-Bromo-2,4-diaminopyridine|S...SMILES: C1=C(C(=CN=C1N)Br)NInChIKey: GNOTUWYODYTQCO-UHFFFAOYSA-NInChI: InChI=1S/C5H6BrN3/c6-3-2-9-5(8)1-4(3)7/h1-2H,(H4,7,8,9)
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3-(Chloromethyl)-5-methylpyridine, HCl
Cas Number: 1007089-84-0Formula: C7H8ClN.ClHMolecular weight: 178.1Synonyms: 3-(Chloromethyl)-5-methylpyridine hydrochloride|1007089-84-0|3-Chloromethyl-5-methylpyridine hydroch...SMILES: CC1=CC(=CN=C1)CCl.ClInChIKey: NCAHREJYXFDWGE-UHFFFAOYSA-NInChI: InChI=1S/C7H8ClN.ClH/c1-6-2-7(3-8)5-9-4-6;/h2,4-5H,3H2,1H3;1H
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Cetirizine-d4
Cas Number: 1219803-84-5Formula: C21H21D4ClN2O3Molecular weight: 465.83Synonyms: 2-[2-[4-[(4-Chlorophenyl)-phenylmethyl]piperazin-1-yl]-1,1,2,2-tetradeuterioethoxy]acetic acid;hydro...SMILES: C1CN(CCN1CCOCC(=O)O)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.ClInChIKey: CUSPGNDCPOVPBA-AKJKYJKUSA-NInChI: InChI=1S/C21H25ClN2O3.ClH/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26;/h1-9,21H,10-16H2,(H,25,26);1H/i14D2,15D2;
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5-Methoxy-N-phenylnicotinamide
Cas Number: 1138443-84-1Formula: C13H12N2O2Molecular weight: 228.25Synonyms: AKOS015851679 | MFCD11857643 | 5-Methoxy-N-phenylnicotinamide, AldrichCPR | 5-methoxy-N-phenylpyridi...SMILES: COC1=CN=CC(=C1)C(=O)NC2=CC=CC=C2InChIKey: JCZHMRPQYHZDCK-UHFFFAOYSA-NInChI: InChI=1S/C13H12N2O2/c1-17-12-7-10(8-14-9-12)13(16)15-11-5-3-2-4-6-11/h2-9H,1H3,(H,15,16)
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3-Bromo-5-butoxyphenylboronic acid(contains varying amounts of Anhydride)
Cas Number: 1072951-84-8Formula: C10H14BBrO2Molecular weight: 256.93Synonyms: 1072951-84-8|3-Bromo-5-butoxyphenylboronic acid|(3-Bromo-5-butoxyphenyl)boronic acid|DTXSID10584765|...SMILES: B(C1=CC(=CC(=C1)Br)OCCCC)(O)OInChIKey: OWWZXOTWNAQSTF-UHFFFAOYSA-NInChI: InChI=1S/C10H14BBrO3/c1-2-3-4-15-10-6-8(11(13)14)5-9(12)7-10/h5-7,13-14H,2-4H2,1H3
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3-Bromo-5-(trifluoromethyl)phenol
Cas Number: 1025718-84-6Formula: C7H4Br3OMolecular weight: 241Synonyms: 3-Bromo-5-(trifluoromethyl)phenol|1025718-84-6|3-Bromo-5-Trifluoromethylphenol|Phenol, 3-bromo-5-(tr...SMILES: C1=C(C=C(C=C1O)Br)C(F)(F)FInChIKey: BWJBVICFLRSNNM-UHFFFAOYSA-NInChI: InChI=1S/C7H4BrF3O/c8-5-1-4(7(9,10)11)2-6(12)3-5/h1-3,12H
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5-Bromo-3-(trifluoromethyl)picolinic acid
Cas Number: 1211580-84-5Formula: C7H3NO2F3BrMolecular weight: 270Synonyms: 1211580-84-5|5-bromo-3-(trifluoromethyl)pyridine-2-carboxylic acid|5-bromo-3-(trifluoromethyl)picoli...SMILES: C1=C(C=NC(=C1C(F)(F)F)C(=O)O)BrInChIKey: PQVPMPDGEIKZRG-UHFFFAOYSA-NInChI: InChI=1S/C7H3BrF3NO2/c8-3-1-4(7(9,10)11)5(6(13)14)12-2-3/h1-2H,(H,13,14)
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Dicyclohexylphosphine (Cy2PH)
Cas Number: 829-84-5Formula: C12H23PMolecular weight: 198.29Synonyms: DICYCLOHEXYLPHOSPHINE|dicyclohexylphosphane|829-84-5|Phosphine, dicyclohexyl-|MFCD00014296|EINECS 21...SMILES: C1CCC(CC1)PC2CCCCC2InChIKey: HDULBKVLSJEMGN-UHFFFAOYSA-NInChI: InChI=1S/C12H23P/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h11-13H,1-10H2
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2 Citations 
