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Search results for: '87-89-8'
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Methyl 4-fluoro-1H-pyrrole-2-carboxylate
Cas Number: 475561-89-8Formula: C6H6FNO2Molecular weight: 143.1Synonyms: Methyl 4-fluoro-1H-pyrrole-2-carboxylate|475561-89-8|Methyl 4-Fluoropyrrole-2-carboxylate|MFCD110425...SMILES: COC(=O)C1=CC(=CN1)FInChIKey: DQCVQMRMLSMVDL-UHFFFAOYSA-NInChI: InChI=1S/C6H6FNO2/c1-10-6(9)5-2-4(7)3-8-5/h2-3,8H,1H3
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5-Bromo-1-chloro-2,4-difluorobenzene
Cas Number: 914636-89-8Formula: C6H2BrClF2Molecular weight: 227.4Synonyms: 1-bromo-5-chloro-2,4-difluorobenzene|914636-89-8|5-Bromo-1-chloro-2,4-difluorobenzene|5-Chloro-2,4-d...SMILES: C1=C(C(=CC(=C1F)Br)Cl)FInChIKey: DFZLCASDRZHHFT-UHFFFAOYSA-NInChI: InChI=1S/C6H2BrClF2/c7-3-1-4(8)6(10)2-5(3)9/h1-2H
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4-(Methylthio)benzaldehyde
Cas Number: 3446-89-7Formula: C8H8OSMolecular weight: 152.21Synonyms: 1TVQ11BIY8 | CAS-3446-89-7 | Quinoline, 4-amino- | 4-(Methylsulfanyl)benzaldehyde | EN300-20437 | UN...SMILES: CSC1=CC=C(C=C1)C=OInChIKey: QRVYABWJVXXOTN-UHFFFAOYSA-NInChI: InChI=1S/C8H8OS/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3
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Methyl 4-bromo-1h-pyrazole-3-carboxylate
Cas Number: 81190-89-8Formula: C5H5BrN2O2Molecular weight: 205Synonyms: methyl 4-bromo-1H-pyrazole-3-carboxylate|81190-89-8|methyl 4-bromo-1H-pyrazole-5-carboxylate|190263-...SMILES: COC(=O)C1=C(C=NN1)BrInChIKey: KWQDACZQHJCUNK-UHFFFAOYSA-NInChI: InChI=1S/C5H5BrN2O2/c1-10-5(9)4-3(6)2-7-8-4/h2H,1H3,(H,7,8)
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trans-N1,N1-dimethylcyclobutane-1,3-diamine;dihydrochloride
Cas Number: 2230911-87-0 EC Number: 833-962-2Formula: C6H14N2·2[HCl]Molecular weight: 187.11Synonyms: 2230911-87-0 | 1229625-44-8 | EN300-199934 | N1,N1-Dimethyl-1,3-cyclobutanediamine dihydrochloride |...SMILES: CN(C)C1CC(C1)N.Cl.ClInChIKey: PTXNWDIHHGMSQQ-UHFFFAOYSA-NInChI: InChI=1S/C6H14N2.2ClH/c1-8(2)6-3-5(7)4-6;;/h5-6H,3-4,7H2,1-2H3;2*1H
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[(2R,6R)-6-methylmorpholin-2-yl]methanol;hydrochloride
Cas Number: 2409588-87-8Synonyms: 2409588-87-8 | ((2R,6R)-6-methylmorpholin-2-yl)methanol hydrochloride | [(2R,6R)-6-methylmorpholin-2...SMILES: CC1CNCC(O1)CO.ClInChIKey: NQEYVMOMNKFAEY-KGZKBUQUSA-NInChI: InChI=1S/C6H13NO2.ClH/c1-5-2-7-3-6(4-8)9-5;/h5-8H,2-4H2,1H3;1H/t5-,6-;/m1./s1
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1-(4-bromophenethyl)piperazine
Cas Number: 142962-89-8Formula: C12H17BrN2Molecular weight: 269.18Synonyms: 1-(4-Bromophenethyl)piperazine|142962-89-8|1-[2-(4-Bromophenyl)ethyl]piperazine|1-[2-(4-BROMO-PHENYL...SMILES: C1CN(CCN1)CCC2=CC=C(C=C2)BrInChIKey: RNPHYPDEAQTYBD-UHFFFAOYSA-NInChI: InChI=1S/C12H17BrN2/c13-12-3-1-11(2-4-12)5-8-15-9-6-14-7-10-15/h1-4,14H,5-10H2
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2-Methylthiazole
Cas Number: 3581-87-1Formula: C4H5NSMolecular weight: 99.15Synonyms: 2-Methylthiazole|3581-87-1|2-Methyl-1,3-thiazole|Thiazole, 2-methyl-|7G081N1ERP|MFCD00053144|2-Methy...SMILES: CC1=NC=CS1InChIKey: VZWOXDYRBDIHMA-UHFFFAOYSA-NInChI: InChI=1S/C4H5NS/c1-4-5-2-3-6-4/h2-3H,1H3
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Di(adamantan-1-yl)(butyl)phosphine hydroiodide
Cas Number: 714951-87-8Formula: C24H40IPMolecular weight: 486.45Synonyms: Di(1-adamantyl)-n-butylphosphine hydriodide|714951-87-8|Di(adamantan-1-yl)(butyl)phosphine hydroiodi...SMILES: CCCCP(C12CC3CC(C1)CC(C3)C2)C45CC6CC(C4)CC(C6)C5.IInChIKey: IBXHWLZKSOGUFS-UHFFFAOYSA-NInChI: InChI=1S/C24H39P.HI/c1-2-3-4-25(23-11-17-5-18(12-23)7-19(6-17)13-23)24-14-20-8-21(15-24)10-22(9-20)16-24;/h17-22H,2-16H2,1H3;1H
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(1S,2S)-2-(methoxymethyl)cyclobutan-1-amine hydrochloride
Cas Number: 1807937-89-8Synonyms: 1807937-89-8 | (1S,2S)-2-(methoxymethyl)cyclobutan-1-amine hydrochloride | (1S,2S)-2-(methoxymethyl)...SMILES: COCC1CCC1N.ClInChIKey: RLNWNMHXJFSLNO-IBTYICNHSA-NInChI: InChI=1S/C6H13NO.ClH/c1-8-4-5-2-3-6(5)7;/h5-6H,2-4,7H2,1H3;1H/t5-,6+;/m1./s1
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3-Fluoro-5-(trifluoromethyl)phenol
Cas Number: 172333-87-8Formula: C7H4F4OMolecular weight: 180.1Synonyms: 3-Fluoro-5-(trifluoromethyl)phenol|172333-87-8|3-FLUORO-5-TRIFLUOROMETHYLPHENOL|MFCD00061288|3-fluor...SMILES: C1=C(C=C(C=C1O)F)C(F)(F)FInChIKey: VNTKPYNBATZMSV-UHFFFAOYSA-NInChI: InChI=1S/C7H4F4O/c8-5-1-4(7(9,10)11)2-6(12)3-5/h1-3,12H
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ONO-DI-004, Agonist of EP 1 receptor
Cas Number: 250605-97-1Synonyms: ONO-DI-004|87-71-8|GTPL1914|SCHEMBL1273561|DTXSID20415516|4-[2-[(1R,2R,3R)-3-hydroxy-2-[(E,3S,5S)-3-...SMILES: CCCC[C@@H](C[C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1CC(=O)C1CCC(CC1)C(=O)O)O)CInChIKey: KWRRIFVHVJWXPU-HVCOQRSISA-NInChI: InChI=1S/C24H38O6/c1-3-4-5-15(2)12-18(25)10-11-19-20(23(28)14-22(19)27)13-21(26)16-6-8-17(9-7-16)24(29)30/h10-11,15-20,22,25,27H,3-9,12-14H2,1-2H3,(H,29,30)/b11-10+/t15-,16?,17?,18+,19+,20+,22+/m0/s1
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ONC206
Cas Number: 1638178-87-6Formula: C23H22F2N4OMolecular weight: 408.44Synonyms: ONC206|1638178-87-6|UNII-OW6LM47PNK|ONC-206|OW6LM47PNK|11-benzyl-7-[(2,4-difluorophenyl)methyl]-2,5,...SMILES: C1CN(CC2=C1N3CCN=C3N(C2=O)CC4=C(C=C(C=C4)F)F)CC5=CC=CC=C5InChIKey: ITMGVSSHWMTJRR-UHFFFAOYSA-NInChI: InChI=1S/C23H22F2N4O/c24-18-7-6-17(20(25)12-18)14-29-22(30)19-15-27(13-16-4-2-1-3-5-16)10-8-21(19)28-11-9-26-23(28)29/h1-7,12H,8-11,13-15H2
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N1,N1-dimethylcyclobutane-1,3-diamine dihydrochloride
Cas Number: 1229625-44-8 EC Number: 833-962-2Formula: C6H16Cl2N2Molecular weight: 187.11Synonyms: 2230911-87-0 | 1229625-44-8 | EN300-199934 | N1,N1-Dimethyl-1,3-cyclobutanediamine dihydrochloride |...SMILES: CN(C)C1CC(C1)N.Cl.ClInChIKey: PTXNWDIHHGMSQQ-UHFFFAOYSA-NInChI: InChI=1S/C6H14N2.2ClH/c1-8(2)6-3-5(7)4-6;;/h5-6H,3-4,7H2,1-2H3;2*1H
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(4-amino-2-oxabicyclo[2.1.1]hexan-1-yl)methanol;hydrochloride
Cas Number: 2260930-89-8Formula: C6H11NO2·HClMolecular weight: 165.62Synonyms: 2260930-89-8 | (4-Amino-2-oxabicyclo[2.1.1]hexan-1-yl)methanol hydrochloride | (4-amino-2-oxabicyclo...SMILES: C1C2(CC1(OC2)CO)N.ClInChIKey: SRBJMMDYARTNCQ-UHFFFAOYSA-NInChI: InChI=1S/C6H11NO2.ClH/c7-5-1-6(2-5,3-8)9-4-5;/h8H,1-4,7H2;1H
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3-Nitrophenyl isocyanate
Cas Number: 3320-87-4Formula: C7H4N2O3Molecular weight: 164.12Synonyms: 3-Nitrophenyl isocyanate|3320-87-4|1-Isocyanato-3-nitrobenzene|m-Nitrophenyl isocyanate|3-Nitropheny...SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])N=C=OInChIKey: GFFGYTMCNVMFAJ-UHFFFAOYSA-NInChI: InChI=1S/C7H4N2O3/c10-5-8-6-2-1-3-7(4-6)9(11)12/h1-4H
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cis-2-phenylcyclopropane-1-carboxylic acid
Cas Number: 939-89-9Formula: C10H10O2Molecular weight: 162.1852Synonyms: 939-89-9|(1R,2S)-rel-2-Phenylcyclopropanecarboxylic acid|48126-51-8|(1r,2s)-2-phenylcyclopropanecarb...SMILES: C1C(C1C(=O)O)C2=CC=CC=C2InChIKey: AHDDRJBFJBDEPW-RKDXNWHRSA-NInChI: InChI=1S/C10H10O2/c11-10(12)9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6H2,(H,11,12)/t8-,9-/m1/s1
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Azido-PEG4-(CH2)3OH
Cas Number: 2028281-87-8Formula: C11H23N3O5Molecular weight: 277.3Synonyms: BP-23359 | 3-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]propan-1-ol | 2028281-87-8 | 1-azido-3,6,9...SMILES: C(CO)COCCOCCOCCOCCN=[N+]=[N-]InChIKey: GGAFKPLUTSFPET-UHFFFAOYSA-NInChI: InChI=1S/C11H23N3O5/c12-14-13-2-5-17-7-9-19-11-10-18-8-6-16-4-1-3-15/h15H,1-11H2
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Methyl 3-aminothieno[2,3-b]pyridine-2-carboxylate
Cas Number: 111042-89-8Formula: C9H8N2O2SMolecular weight: 208.24Synonyms: methyl 3-aminothieno[2,3-b]pyridine-2-carboxylate|111042-89-8|methyl 3-aminothiopheno[2,3-b]pyridine...SMILES: COC(=O)C1=C(C2=C(S1)N=CC=C2)NInChIKey: STCNNBXPNILVDE-UHFFFAOYSA-NInChI: InChI=1S/C9H8N2O2S/c1-13-9(12)7-6(10)5-3-2-4-11-8(5)14-7/h2-4H,10H2,1H3
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4-(4-Bromo-2-fluorophenyl)morpholine
Cas Number: 513068-89-8Formula: C10H11BrFNOMolecular weight: 260.103Synonyms: 4-(4-Bromo-2-fluorophenyl)morpholine|513068-89-8|MFCD11846942|4-(4-Bromo-2-fluoro-phenyl)-morpholine...SMILES: C1COCCN1C2=C(C=C(C=C2)Br)FInChIKey: LJQJHWZLMLYPJV-UHFFFAOYSA-NInChI: InChI=1S/C10H11BrFNO/c11-8-1-2-10(9(12)7-8)13-3-5-14-6-4-13/h1-2,7H,3-6H2
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3-[(3-Fluorophenyl)amino]propanoic Acid
Cas Number: 885275-89-8Formula: C9H10FNO2Molecular weight: 183.18Synonyms: 3-[(3-Fluorophenyl)amino]propanoic acid|885275-89-8|3-(3-fluoroanilino)propanoic acid|3-((3-Fluoroph...SMILES: C1=CC(=CC(=C1)F)NCCC(=O)OInChIKey: WKMPTGFIUPPIGN-UHFFFAOYSA-NInChI: InChI=1S/C9H10FNO2/c10-7-2-1-3-8(6-7)11-5-4-9(12)13/h1-3,6,11H,4-5H2,(H,12,13)
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1,1 ′: 4 ′,1 ″ terphenyl-3,3 ″,5,5 ″ -tetracarboxylic acid
Cas Number: 921619-89-8Formula: C22H14O8Molecular weight: 406.34Synonyms: 921619-89-8|[1,1':4',1''-Terphenyl]-3,3'',5,5''-tetracarboxylic acid|H4TPTC|[1,1':4',1'']Terphenyl- ...SMILES: C1=CC(=CC=C1C2=CC(=CC(=C2)C(=O)O)C(=O)O)C3=CC(=CC(=C3)C(=O)O)C(=O)OInChIKey: HQCSLVYEWMDWIZ-UHFFFAOYSA-NInChI: InChI=1S/C22H14O8/c23-19(24)15-5-13(6-16(9-15)20(25)26)11-1-2-12(4-3-11)14-7-17(21(27)28)10-18(8-14)22(29)30/h1-10H,(H,23,24)(H,25,26)(H,27,28)(H,29,30)
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2-Amino-N-sec-butylbenzamide
Cas Number: 30391-87-8Formula: C11H16N2OMolecular weight: 192.25Synonyms: 2-Amino-N-(sec-butyl)benzamide|30391-87-8|2-AMINO-N-SEC-BUTYLBENZAMIDE|2-amino-N-butan-2-ylbenzamide...SMILES: CCC(C)NC(=O)C1=CC=CC=C1NInChIKey: UOKULICTTSTSHO-UHFFFAOYSA-NInChI: InChI=1S/C11H16N2O/c1-3-8(2)13-11(14)9-6-4-5-7-10(9)12/h4-8H,3,12H2,1-2H3,(H,13,14)
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Methyl 2-amino-5-bromoisonicotinate
Cas Number: 882499-87-8Formula: C7H7BrN2O2Molecular weight: 231.05Synonyms: 882499-87-8|Methyl 2-amino-5-bromoisonicotinate|methyl 2-amino-5-bromopyridine-4-carboxylate|METHYL ...SMILES: COC(=O)C1=CC(=NC=C1Br)NInChIKey: FJPDYKLTAURVRU-UHFFFAOYSA-NInChI: InChI=1S/C7H7BrN2O2/c1-12-7(11)4-2-6(9)10-3-5(4)8/h2-3H,1H3,(H2,9,10)
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