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Search results for: '1036-49-3'
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Erbium(III) sulfate
Cas Number: 13478-49-4 EC Number: 236-779-0Formula: Er2(SO4)3Molecular weight: 622.71Synonyms: Erbium sulfate|13478-49-4|erbium(3+);trisulfate|Sulfuric acid, erbium(3+) salt (3:2)|859WC72L9X|Dier...SMILES: [O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Er+3].[Er+3]InChIKey: SYDXSHCNMKOQFW-UHFFFAOYSA-HInChI: InChI=1S/2Er.3H2O4S/c;;3*1-5(2,3)4/h;;3*(H2,1,2,3,4)/q2*+3;;;/p-6
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Raceanisodamine
Cas Number: 17659-49-3Formula: C17H23NO4Molecular weight: 305.37Synonyms: racanisodamine|17659-49-3|anisodamine|6-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-p...SMILES: CN1C2CC(CC1C(C2)O)OC(=O)C(CO)C3=CC=CC=C3InChIKey: WTQYWNWRJNXDEG-UHFFFAOYSA-NInChI: InChI=1S/C17H23NO4/c1-18-12-7-13(9-15(18)16(20)8-12)22-17(21)14(10-19)11-5-3-2-4-6-11/h2-6,12-16,19-20H,7-10H2,1H3
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2,4-Dichloropyridine-3-boronic acid pinacol ester
Cas Number: 1257651-49-2Formula: C11H14BCl2NO2Molecular weight: 273.95Synonyms: MB14724 | DTXSID30746343 | AKOS027425393 | 1257651-49-2 | D71880 | 2,4-Dichloropyridine-3-boronic ac...SMILES: B1(OC(C(O1)(C)C)(C)C)C2=C(C=CN=C2Cl)ClInChIKey: ZKIKGOMOMBWEOI-UHFFFAOYSA-NInChI: InChI=1S/C11H14BCl2NO2/c1-10(2)11(3,4)17-12(16-10)8-7(13)5-6-15-9(8)14/h5-6H,1-4H3
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Hydroxyphenyl propamidobenzoic acid
Cas Number: 697235-49-7Formula: C16H15NO4Molecular weight: 285.295Synonyms: 697235-49-7|Hydroxyphenyl propamidobenzoic acid|Dihydroavenanthramide D|Benzoic acid, 2-[[3-(4-hydro...SMILES: C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=CC=C(C=C2)OInChIKey: DLFOKZQWYFNKCL-UHFFFAOYSA-NInChI: InChI=1S/C16H15NO4/c18-12-8-5-11(6-9-12)7-10-15(19)17-14-4-2-1-3-13(14)16(20)21/h1-6,8-9,18H,7,10H2,(H,17,19)(H,20,21)
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3-Isopropyl-5-(trichloromethyl)-1,2,4-oxadiazole
Cas Number: 1199-49-1Formula: C6H7N2OCl3Molecular weight: 229.49Synonyms: 3-Isopropyl-5-(trichloromethyl)-1,2,4-oxadiazole|1199-49-1|3-(propan-2-yl)-5-(trichloromethyl)-1,2,4...SMILES: CC(C)C1=NOC(=N1)C(Cl)(Cl)ClInChIKey: NLZBSAZGBAZSOS-UHFFFAOYSA-NInChI: InChI=1S/C6H7Cl3N2O/c1-3(2)4-10-5(12-11-4)6(7,8)9/h3H,1-2H3
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Trihexyphenidyl Hydrochloride, Muscarinic acetylcholine receptor M1 antagonist
Cas Number: 52-49-3Formula: C20H32ClNOMolecular weight: 337.927Synonyms: Trihexyphenidyl hydrochloride|Benzhexol hydrochloride|52-49-3|Artane|Trihexyphenidyl HCl|Parcopane|R...SMILES: C1CCC(CC1)C(CCN2CCCCC2)(C3=CC=CC=C3)O.ClInChIKey: QDWJJTJNXAKQKD-UHFFFAOYSA-NInChI: InChI=1S/C20H31NO.ClH/c22-20(18-10-4-1-5-11-18,19-12-6-2-7-13-19)14-17-21-15-8-3-9-16-21;/h1,4-5,10-11,19,22H,2-3,6-9,12-17H2;1H
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YS-49
Cas Number: 132836-42-1Formula: C20H20BrNO2Molecular weight: 386.28Synonyms: 1-(Naphthalen-1-ylmethyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrobromide monohydrate | FT-0766...SMILES: C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=CC4=CC=CC=C43.BrInChIKey: JXFRKNGQHAAJKY-UHFFFAOYSA-NInChI: InChI=1S/C20H19NO2.BrH/c22-19-11-15-8-9-21-18(17(15)12-20(19)23)10-14-6-3-5-13-4-1-2-7-16(13)14;/h1-7,11-12,18,21-23H,8-10H2;1H
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Methyl 3-fluoro-4-(methylsulfonyl)benzoate
Cas Number: 1215074-49-9Formula: C9H9FO4SMolecular weight: 232.2Synonyms: 1215074-49-9|METHYL 3-FLUORO-4-(METHYLSULFONYL)BENZOATE|methyl 3-fluoro-4-methylsulfonylbenzoate|Met...SMILES: COC(=O)C1=CC(=C(C=C1)S(=O)(=O)C)FInChIKey: ACDGZYOVJKPTRE-UHFFFAOYSA-NInChI: InChI=1S/C9H9FO4S/c1-14-9(11)6-3-4-8(7(10)5-6)15(2,12)13/h3-5H,1-2H3
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(R)-3-Amino-3-(3-chloro-phenyl)-propionic acid
Cas Number: 262429-49-2Formula: C9H10ClNO2Molecular weight: 199.6Synonyms: 262429-49-2|(R)-3-Amino-3-(3-chloro-phenyl)-propionic acid|(r)-3-(3-chlorophenyl)-beta-alanine|(r)-3...SMILES: C1=CC(=CC(=C1)Cl)C(CC(=O)O)NInChIKey: LIDRHPCWOYOBIZ-MRVPVSSYSA-NInChI: InChI=1S/C9H10ClNO2/c10-7-3-1-2-6(4-7)8(11)5-9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m1/s1
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3'-Methoxypropiophenone
Cas Number: 37951-49-8Formula: C10H12O2Molecular weight: 164.2Synonyms: 3'-Methoxypropiophenone|37951-49-8|1-(3-methoxyphenyl)propan-1-one|1-Propanone, 1-(3-methoxyphenyl)-...SMILES: CCC(=O)C1=CC(=CC=C1)OCInChIKey: LPDJHUUWTGXTCU-UHFFFAOYSA-NInChI: InChI=1S/C10H12O2/c1-3-10(11)8-5-4-6-9(7-8)12-2/h4-7H,3H2,1-2H3
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methyl 3-fluoropyrazine-2-carboxylate
Synonyms: Methyl 3-fluoropyrazine-2-carboxylate|1261487-49-3|2-Pyrazinecarboxylic acid, 3-fluoro-, methyl este...SMILES: COC(=O)C1=NC=CN=C1FInChIKey: YENSZQPOSMPDQW-UHFFFAOYSA-NInChI: InChI=1S/C6H5FN2O2/c1-11-6(10)4-5(7)9-3-2-8-4/h2-3H,1H3
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4-CHLORO-3-NITROBENZENESULFONANILIDE
Cas Number: 137-49-5Formula: C12H9ClN2O4SMolecular weight: 312.734Synonyms: 137-49-5|4-chloro-3-nitro-N-phenylbenzenesulfonamide|Benzenesulfonamide, 4-chloro-3-nitro-N-phenyl-|...SMILES: C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]InChIKey: BEEGBBKQFMABPW-UHFFFAOYSA-NInChI: InChI=1S/C12H9ClN2O4S/c13-11-7-6-10(8-12(11)15(16)17)20(18,19)14-9-4-2-1-3-5-9/h1-8,14H
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2-Chloro-3-methoxyphenol
Cas Number: 72232-49-6Formula: C7H7ClO2Molecular weight: 158.58Synonyms: 2-CHLORO-3-METHOXYPHENOL|72232-49-6|2-Chloro-3-hydroxyanisole|MFCD08275690|Phenol,2-chloro-3-methoxy...SMILES: COC1=CC=CC(=C1Cl)OInChIKey: QGLVWTFUWVTDEQ-UHFFFAOYSA-NInChI: InChI=1S/C7H7ClO2/c1-10-6-4-2-3-5(9)7(6)8/h2-4,9H,1H3
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3-bromo-4-fluoro-1H-pyrazole
Cas Number: 1621526-49-5 EC Number: 874-527-7Formula: C3H2BrFN2Molecular weight: 164.96Synonyms: 3-bromo-4-fluoro-1H-pyrazole | EN300-7536049 | GQHRGRHDKCJTKG-UHFFFAOYSA-N | 5-bromo-4-fluoro-1H-pyr...SMILES: C1=NNC(=C1F)BrInChIKey: GQHRGRHDKCJTKG-UHFFFAOYSA-NInChI: InChI=1S/C3H2BrFN2/c4-3-2(5)1-6-7-3/h1H,(H,6,7)
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1-Benzyl-3-piperidone
Cas Number: 40114-49-6Formula: C12H15NOMolecular weight: 189.25Synonyms: 1-benzylpiperidin-3-one|40114-49-6|1-Benzyl-3-piperidone|1-Benzyl-3-piperidinone|3-Piperidinone, 1-(...SMILES: C1CC(=O)CN(C1)CC2=CC=CC=C2InChIKey: BBQQULRBTOMLTC-UHFFFAOYSA-NInChI: InChI=1S/C12H15NO/c14-12-7-4-8-13(10-12)9-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2
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cis-3-Hexenyl phenylacetate
Cas Number: 42436-07-7 EC Number: 255-826-6Formula: C14H18O2Molecular weight: 218.29Synonyms: cis-3-Hexenyl phenylacetate, >=98%, stabilized, FG | FEMA 3633 | UNII-8XZ0MZ4575 | (Z)-3-Hexenyl phe...SMILES: CCC=CCCOC(=O)CC1=CC=CC=C1InChIKey: FJKFIIYSBXHBCT-ARJAWSKDSA-NInChI: InChI=1S/C14H18O2/c1-2-3-4-8-11-16-14(15)12-13-9-6-5-7-10-13/h3-7,9-10H,2,8,11-12H2,1H3/b4-3-
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3-methoxy-1H-pyrazole-4-carboxylic acid
Cas Number: 478968-49-9Formula: C5H6N2O3Molecular weight: 142.11Synonyms: 3-Methoxy-1H-pyrazole-4-carboxylic acid | 478968-49-9 | 5-methoxy-1H-pyrazole-4-carboxylic acid | 1H...SMILES: COC1=C(C=NN1)C(=O)OInChIKey: DKRJYDYNPAQHHO-UHFFFAOYSA-NInChI: InChI=1S/C5H6N2O3/c1-10-4-3(5(8)9)2-6-7-4/h2H,1H3,(H,6,7)(H,8,9)
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3-Hydroxy-5-methylpyridine
Cas Number: 42732-49-0Formula: C6H7NOMolecular weight: 109.13Synonyms: 3-Hydroxy-5-picoline|42732-49-0|3-Hydroxy-5-methylpyridine|5-methylpyridin-3-ol|5-Methyl-3-hydroxypy...SMILES: CC1=CC(=CN=C1)OInChIKey: RYJNCIGFPWGVPA-UHFFFAOYSA-NInChI: InChI=1S/C6H7NO/c1-5-2-6(8)4-7-3-5/h2-4,8H,1H3
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1-Methyl-3-tetradecyl-1H-imidazol-3-ium bis((trifluoromethyl)sulfonyl)amide
Cas Number: 404001-49-6Formula: C20H35F6N3O4S2Molecular weight: 559.63Synonyms: 404001-49-6|1-Methyl-3-tetradecylimidazolium bis(trifluoromethylsulfonyl)imide|DTXSID9049297|1-Methy...SMILES: CCCCCCCCCCCCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)FInChIKey: AEZLAQZYZLLTIV-UHFFFAOYSA-NInChI: InChI=1S/C18H35N2.C2F6NO4S2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20-17-16-19(2)18-20;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h16-18H,3-15H2,1-2H3;/q+1;-1
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Benzyl 6-aminonicotinate
Cas Number: 935687-49-3Formula: C13H12N2O2Molecular weight: 228.25Synonyms: Benzyl 6-aminonicotinate|935687-49-3|Benzyl 6-aminopyridine-3-carboxylate|6-Aminonicotinic acid benz...SMILES: C1=CC=C(C=C1)COC(=O)C2=CN=C(C=C2)NInChIKey: WZFRFMFRNZBTPU-UHFFFAOYSA-NInChI: InChI=1S/C13H12N2O2/c14-12-7-6-11(8-15-12)13(16)17-9-10-4-2-1-3-5-10/h1-8H,9H2,(H2,14,15)
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(3-chloro-5-(trifluoromethyl)pyridin-2-yl)methanamine hydrochloride
Cas Number: 326476-49-7Formula: C7H6ClF3N2·HClMolecular weight: 247.05Synonyms: 326476-49-7|(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)methanamine hydrochloride|2-(Aminomethyl)-3-ch...SMILES: C1=C(C=NC(=C1Cl)CN)C(F)(F)F.ClInChIKey: DIEGHTBYTFRSDU-UHFFFAOYSA-NInChI: InChI=1S/C7H6ClF3N2.ClH/c8-5-1-4(7(9,10)11)3-13-6(5)2-12;/h1,3H,2,12H2;1H
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trans-3-(difluoromethyl)cyclobutanecarboxylic acid
Cas Number: 1773508-02-3Formula: C6H8O2F2Molecular weight: 150.12Synonyms: cis-3-(difluoromethyl)cyclobutane-1-carboxylic acid | cis-3-(difluoromethyl)cyclobutane-1-carboxylic...SMILES: C1C(CC1C(=O)O)C(F)FInChIKey: XRSUGPIWOGKMJP-UHFFFAOYSA-NInChI: InChI=1S/C6H8F2O2/c7-5(8)3-1-4(2-3)6(9)10/h3-5H,1-2H2,(H,9,10)
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Calix[8]arene
Cas Number: 82452-93-5Formula: C56H48O8Molecular weight: 848.98Synonyms: SCHEMBL12168748 | Calix(8)arene | MFCD00143914 | Calix[8]arene, technical, >=90% (CH) | W-203872 | n...SMILES: C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=C(C(=CC=C5)CC6=CC=CC(=C6O)CC7=CC=CC(=C7O)CC8=CC=CC(=C8O)CC9=CC=CC1=C9O)O)O)O)OInChIKey: HDPRHRZFFPXZIL-UHFFFAOYSA-NInChI: See more
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7-Methoxy-2,3-dihydro-1,8-naphthyridin-4(1H)-one
Cas Number: 82070-49-3Formula: C9H10N2O2Molecular weight: 178.19Synonyms: 7-METHOXY-2,3-DIHYDRO-1,8-NAPHTHYRIDIN-4(1H)-ONE|82070-49-3|7-methoxy-2,3-dihydro-1H-1,8-naphthyridi...SMILES: COC1=NC2=C(C=C1)C(=O)CCN2InChIKey: WCMJRFNURGOUQZ-UHFFFAOYSA-NInChI: InChI=1S/C9H10N2O2/c1-13-8-3-2-6-7(12)4-5-10-9(6)11-8/h2-3H,4-5H2,1H3,(H,10,11)
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