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Search results for: '1003711-04-3'
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(2S)-4,4-difluoropyrrolidine-2-carbonitrile;hydrochloride
Cas Number: 869489-04-3Formula: C5H7ClF2N2Molecular weight: 168.57Synonyms: (S)-4,4-Difluoropyrrolidine-2-carbonitrile hydrochloride | 869489-04-3 | (2S)-4,4-difluoropyrrolidin...SMILES: C1C(NCC1(F)F)C#N.ClInChIKey: BOGMTOHWIVLVJE-WCCKRBBISA-NInChI: InChI=1S/C5H6F2N2.ClH/c6-5(7)1-4(2-8)9-3-5;/h4,9H,1,3H2;1H/t4-;/m0./s1
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3-Chloro-1-(2-fluorophenyl)propan-1-one
Cas Number: 898767-04-9Formula: C9H8ClFOMolecular weight: 186.6Synonyms: 3-Chloro-1-(2-fluorophenyl)propan-1-one|898767-04-9|3-chloro-1-(2-fluorophenyl)-1-propanone|3-Chloro...SMILES: C1=CC=C(C(=C1)C(=O)CCCl)FInChIKey: WCNSDVGUYXGZDE-UHFFFAOYSA-NInChI: InChI=1S/C9H8ClFO/c10-6-5-9(12)7-3-1-2-4-8(7)11/h1-4H,5-6H2
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6-(3-Aminophenyl)-2-hydroxypyridine
Cas Number: 161887-04-3Formula: C11H10N2OMolecular weight: 186.2Synonyms: 6-(3-Aminophenyl)pyridin-2-ol|161887-04-3|6-(3-AMINOPHENYL)-2-HYDROXYPYRIDINE|6-(3-aminophenyl)-1H-p...SMILES: C1=CC(=CC(=C1)N)C2=CC=CC(=O)N2InChIKey: UAVKFUCNJPJKMI-UHFFFAOYSA-NInChI: InChI=1S/C11H10N2O/c12-9-4-1-3-8(7-9)10-5-2-6-11(14)13-10/h1-7H,12H2,(H,13,14)
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3-({[(tert-butoxy)carbonyl]amino}methyl)cyclobutane-1-carboxylic acid
Cas Number: 1630907-04-8Formula: C11H19NO4Molecular weight: 229.276Synonyms: 1630907-04-8|1427319-48-9|3-(((TERT-BUTOXYCARBONYL)AMINO)METHYL)CYCLOBUTANECARBOXYLIC ACID|1638772-0...SMILES: CC(C)(C)OC(=O)NCC1CC(C1)C(=O)OInChIKey: NBZXLLZSQJEBME-UHFFFAOYSA-NInChI: InChI=1S/C11H19NO4/c1-11(2,3)16-10(15)12-6-7-4-8(5-7)9(13)14/h7-8H,4-6H2,1-3H3,(H,12,15)(H,13,14)
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3-Bromo-5-isopropoxybenzoic acid
Cas Number: 1119779-04-2Formula: C10H11BrO3Molecular weight: 259.1Synonyms: 3-BROMO-5-ISOPROPOXYBENZOIC ACID|1119779-04-2|3-bromo-5-propan-2-yloxybenzoic acid|3-bromo-5-(propan...SMILES: CC(C)OC1=CC(=CC(=C1)C(=O)O)BrInChIKey: NJBLBPFZZDTKTM-UHFFFAOYSA-NInChI: InChI=1S/C10H11BrO3/c1-6(2)14-9-4-7(10(12)13)3-8(11)5-9/h3-6H,1-2H3,(H,12,13)
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Amberlite® IRC120 Na ion exchange resin
Cas Number: 78922-04-0Synonyms: 749884-42-2|78922-04-0|3-((3-chlorophenyl)sulfonamido)benzoic acid|3-(3-chloro-benzenesulfonylamino)...SMILES: C1=CC(=CC(=C1)NS(=O)(=O)C2=CC(=CC=C2)Cl)C(=O)OInChIKey: APBOVLPLJFJSRI-UHFFFAOYSA-NInChI: InChI=1S/C13H10ClNO4S/c14-10-4-2-6-12(8-10)20(18,19)15-11-5-1-3-9(7-11)13(16)17/h1-8,15H,(H,16,17)
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tert-butyl 3-hydroxyazocane-1-carboxylate
Cas Number: 194492-04-1Formula: C12H23NO3Molecular weight: 229.32Synonyms: 194492-04-1 | tert-butyl 3-hydroxyazocane-1-carboxylate | 1(2H)-Azocinecarboxylic acid, hexahydro-3-...SMILES: CC(C)(C)OC(=O)N1CCCCCC(C1)OInChIKey: JUOQXDSGRSCNHW-UHFFFAOYSA-NInChI: InChI=1S/C12H23NO3/c1-12(2,3)16-11(15)13-8-6-4-5-7-10(14)9-13/h10,14H,4-9H2,1-3H3
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Glycopyrrolate, Muscarinic acetylcholine receptor M1 antagonist
Formula: C19H28NO3·BrMolecular weight: 398.33Synonyms: Glycopyrrolate [USAN:USP] | HMS2097E14 | Glycopyrrolate (USP) | NCGC00179456-04 | Nodapton | SCHEMBL...SMILES: C[N+]1(CCC(C1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)O)C.[Br-]InChIKey: VPNYRYCIDCJBOM-UHFFFAOYSA-MInChI: InChI=1S/C19H28NO3.BrH/c1-20(2)13-12-17(14-20)23-18(21)19(22,16-10-6-7-11-16)15-8-4-3-5-9-15;/h3-5,8-9,16-17,22H,6-7,10-14H2,1-2H3;1H/q+1;/p-1
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3,4-Difluorobenzamide
Cas Number: 85118-04-3Formula: C7H5F2NOMolecular weight: 157.12Synonyms: 3,4-Difluorobenzamide|85118-04-3|MFCD00015549|Benzamide, 3,4-fluoro-|2HO|EINECS 285-656-8|3,4-diflur...SMILES: C1=CC(=C(C=C1C(=O)N)F)FInChIKey: CMWOHNIHUBDEAG-UHFFFAOYSA-NInChI: InChI=1S/C7H5F2NO/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H2,10,11)
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cis-3-(aminomethyl)cyclobutanol hydrochloride
Cas Number: 1400744-20-8Formula: C5H12ClNOMolecular weight: 137.61Synonyms: 3-(Aminomethyl)cyclobutanol hydrochloride|trans-3-(Aminomethyl)cyclobutanol hydrochloride|1400744-20...SMILES: C1C(CC1O)CN.ClInChIKey: NZNRVZGKQUALNR-UHFFFAOYSA-NInChI: InChI=1S/C5H11NO.ClH/c6-3-4-1-5(7)2-4;/h4-5,7H,1-3,6H2;1H
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Ethyl 4-oxo-7-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylate
Cas Number: 71083-04-0Formula: C13H10F3NO3Molecular weight: 285.2Synonyms: 391-02-6|ethyl 4-hydroxy-7-(trifluoromethyl)quinoline-3-carboxylate|Ethyl 4-oxo-7-(trifluoromethyl)-...SMILES: CCOC(=O)C1=CNC2=C(C1=O)C=CC(=C2)C(F)(F)FInChIKey: YHUWNMJUAZJACG-UHFFFAOYSA-NInChI: InChI=1S/C13H10F3NO3/c1-2-20-12(19)9-6-17-10-5-7(13(14,15)16)3-4-8(10)11(9)18/h3-6H,2H2,1H3,(H,17,18)
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2-Iodo-3-methoxypyrazine
Cas Number: 58139-04-1Formula: C5H5IN2OMolecular weight: 236Synonyms: 2-Iodo-3-methoxypyrazine|58139-04-1|MFCD09955597|SCHEMBL1899290|DTXSID20450523|PDMRYBKGSOJHJJ-UHFFFA...SMILES: COC1=NC=CN=C1IInChIKey: PDMRYBKGSOJHJJ-UHFFFAOYSA-NInChI: InChI=1S/C5H5IN2O/c1-9-5-4(6)7-2-3-8-5/h2-3H,1H3
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cis-3-aminocyclohexane-1-carboxylic acid
Cas Number: 118785-96-9Formula: C7H14ClNO2Molecular weight: 179.64Synonyms: 118785-96-9|(1R,3S)-3-Aminocyclohexanecarboxylic acid hydrochloride|cis-3-aminocyclohexane-1-carboxy...SMILES: C1CC(CC(C1)N)C(=O)O.ClInChIKey: BOUHXQPJYJANEO-IBTYICNHSA-NInChI: InChI=1S/C7H13NO2.ClH/c8-6-3-1-2-5(4-6)7(9)10;/h5-6H,1-4,8H2,(H,9,10);1H/t5-,6+;/m1./s1
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2-(3,4-Epoxycyclohexyl)ethyltrimethoxysilane
Cas Number: 3388-04-3Formula: C11H22O4SiMolecular weight: 246.38Synonyms: 7-Oxabicyclo[4.1.0]heptane, 3-[2-(trimethoxysilyl)ethyl]- | AI3-52751 | beta-(3,4-Epoxycyclohexyl)et...SMILES: CO[Si](CCC1CCC2C(C1)O2)(OC)OCInChIKey: DQZNLOXENNXVAD-UHFFFAOYSA-NInChI: InChI=1S/C11H22O4Si/c1-12-16(13-2,14-3)7-6-9-4-5-10-11(8-9)15-10/h9-11H,4-8H2,1-3H3
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3-Bromo-6-fluoro-1H-indazole
Cas Number: 885522-04-3Formula: C7H4BrFN2Molecular weight: 215.02Synonyms: 3-Bromo-6-fluoro-1H-indazole|885522-04-3|3-bromo-6-fluoro-2H-indazole|3-BROMO-6-FLUORO (1H)INDAZOLE|...SMILES: C1=CC2=C(NN=C2C=C1F)BrInChIKey: HXIMDHPWCHNHMM-UHFFFAOYSA-NInChI: InChI=1S/C7H4BrFN2/c8-7-5-2-1-4(9)3-6(5)10-11-7/h1-3H,(H,10,11)
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3-(4-tert-Butylphenyl)-3-oxopropanenitrile
Cas Number: 39528-62-6Formula: C13H15NOMolecular weight: 201.26Synonyms: 39528-62-6|3-(4-tert-butylphenyl)-3-oxopropanenitrile|4-tert-Butylbenzoylacetonitrile|3-(4-(tert-But...SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)CC#NInChIKey: LKZFEKFWLCDIBF-UHFFFAOYSA-NInChI: InChI=1S/C13H15NO/c1-13(2,3)11-6-4-10(5-7-11)12(15)8-9-14/h4-7H,8H2,1-3H3
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(1R,3S)-3-methoxycyclopentanamine;hydrochloride
Cas Number: 2173637-04-0Synonyms: cis-3-methoxycyclopentan-1-amine hydrochloride | 2173637-04-0 | (1R,3S)-3-methoxycyclopentanamine | ...SMILES: COC1CCC(C1)N.ClInChIKey: OYCZONWJWLKAEF-IBTYICNHSA-NInChI: InChI=1S/C6H13NO.ClH/c1-8-6-3-2-5(7)4-6;/h5-6H,2-4,7H2,1H3;1H/t5-,6+;/m1./s1
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TetrahydroCurcumin
Cas Number: 36062-04-1(DMSO)Formula: C21H24O6Molecular weight: 372.412Synonyms: Tetrahydrocurcumin|36062-04-1|1,7-bis(4-hydroxy-3-methoxyphenyl)heptane-3,5-dione|Sabiwhite|Tetrahyd...SMILES: COC1=C(C=CC(=C1)CCC(=O)CC(=O)CCC2=CC(=C(C=C2)O)OC)OInChIKey: LBTVHXHERHESKG-UHFFFAOYSA-NInChI: InChI=1S/C21H24O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h5-6,9-12,24-25H,3-4,7-8,13H2,1-2H3
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1,2-diheptanoyl-sn-glycero-3-phosphocholine
Cas Number: 39036-04-9 EC Number: 200-663-8Formula: C22H44NO8PMolecular weight: 481.56Synonyms: Diheptanoyllecithin|1,2-diheptanoyl-sn-glycero-3-phosphocholine|39036-04-9|L-alpha-Diheptanoyllecith...SMILES: CCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCInChIKey: RBFSPQDASPEAID-HXUWFJFHSA-NInChI: InChI=1S/C22H44NO8P/c1-6-8-10-12-14-21(24)28-18-20(31-22(25)15-13-11-9-7-2)19-30-32(26,27)29-17-16-23(3,4)5/h20H,6-19H2,1-5H3/t20-/m1/s1
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3-Aminopropylphosphonic acid
Cas Number: 13138-33-5Formula: C3H10NO3PMolecular weight: 139.09Synonyms: Ethyl 1-N-Boc-3-oxo-piperidine-4-carboxylate | NCGC00015085-03 | NSC 133832 | Lopac0_000080 | NCGC00...SMILES: C(CN)CP(=O)(O)OInChIKey: GSZQTIFGANBTNF-UHFFFAOYSA-NInChI: InChI=1S/C3H10NO3P/c4-2-1-3-8(5,6)7/h1-4H2,(H2,5,6,7)
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3-Oxetanyl p-Toluenesulfonate
Cas Number: 26272-83-3Formula: C10H12O4SMolecular weight: 228.26Synonyms: PB16036 | 3-OXETANOL, 3-(4-METHYLBENZENESULFONATE) | UMFWNFVHKAJOSE-UHFFFAOYSA-N | NCGC00015589-04 |...SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC2COC2InChIKey: UMFWNFVHKAJOSE-UHFFFAOYSA-NInChI: InChI=1S/C10H12O4S/c1-8-2-4-10(5-3-8)15(11,12)14-9-6-13-7-9/h2-5,9H,6-7H2,1H3
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1-(3-methyloxetan-3-yl)ethan-1-one
Cas Number: 1363381-04-7Formula: C6H10O2Molecular weight: 114.144Synonyms: 1-(3-Methyloxetan-3-yl)ethanone|1363381-04-7|1-(3-METHYL-OXETAN-3-YL)ETHANONE|1-(3-METHYLOXETAN-3-YL...SMILES: CC(=O)C1(COC1)CInChIKey: QDRLIWDQZUUUGX-UHFFFAOYSA-NInChI: InChI=1S/C6H10O2/c1-5(7)6(2)3-8-4-6/h3-4H2,1-2H3
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Ethyl 2,4-dichloronicotinate
Cas Number: 62022-04-2Formula: C8H7Cl2NO2Molecular weight: 220.1Synonyms: ethyl 2,4-dichloronicotinate|62022-04-2|ethyl 2,4-dichloropyridine-3-carboxylate|ETHYL-2,4-DICHLORON...SMILES: CCOC(=O)C1=C(C=CN=C1Cl)ClInChIKey: KMFWUAUMIFXMBF-UHFFFAOYSA-NInChI: InChI=1S/C8H7Cl2NO2/c1-2-13-8(12)6-5(9)3-4-11-7(6)10/h3-4H,2H2,1H3
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Zonisamide-d4
Cas Number: 1020720-04-0Formula: C8H4D4N2O3SMolecular weight: 216.25Synonyms: 1-[(~2~H_4_)-1,2-Benzoxazol-3-yl]methanesulfonamide | 3-(Sulfamoylmethyl)-1,2-benzisoxazole-d4 | 102...SMILES: C1=CC=C2C(=C1)C(=NO2)CS(=O)(=O)NInChIKey: UBQNRHZMVUUOMG-RHQRLBAQSA-NInChI: InChI=1S/C8H8N2O3S/c9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2,(H2,9,11,12)/i1D,2D,3D,4D
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