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Search results for: '105-53-3'
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tert-butyl 3-(hydroxymethyl)-2-methyl-azetidine-1-carboxylate
Cas Number: 2090335-53-6Formula: C10H19NO3Molecular weight: 201.26Synonyms: 2090335-53-6 | tert-butyl 3-(hydroxymethyl)-2-methyl-azetidine-1-carboxylate | tert-butyl 3-(hydroxy...SMILES: CC1C(CN1C(=O)OC(C)(C)C)COInChIKey: GCKYULDQJWNXBA-UHFFFAOYSA-NInChI: InChI=1S/C10H19NO3/c1-7-8(6-12)5-11(7)9(13)14-10(2,3)4/h7-8,12H,5-6H2,1-4H3
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5-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
Cas Number: 1135283-53-2Formula: C9H5F3N2OMolecular weight: 214.14Synonyms: J-516438 | KC-0769 | 1135283-53-2 | DTXSID30653220 | SCHEMBL1714153 | SB14413 | 5-(Trifluoromethyl)-...SMILES: C1=C(C=NC2=C1C(=CN2)C=O)C(F)(F)FInChIKey: KZSQRUZLWCOUOV-UHFFFAOYSA-NInChI: InChI=1S/C9H5F3N2O/c10-9(11,12)6-1-7-5(4-15)2-13-8(7)14-3-6/h1-4H,(H,13,14)
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(1-methylcyclobutyl)methanamine hydrochloride
Cas Number: 1245647-53-3Formula: C6H14ClNMolecular weight: 135.64Synonyms: (1-methylcyclobutyl)methanamine hydrochloride|1245647-53-3|(1-methylcyclobutyl)methanamine;hydrochlo...SMILES: CC1(CCC1)CN.ClInChIKey: QIDPAPJHVFAHPT-UHFFFAOYSA-NInChI: InChI=1S/C6H13N.ClH/c1-6(5-7)3-2-4-6;/h2-5,7H2,1H3;1H
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3-(4-BROMOPHENYL)-5-ISOXAZOLAMINE
Cas Number: 119162-53-7Formula: C9H7BrN2OMolecular weight: 239.073Synonyms: 119162-53-7|3-(4-Bromophenyl)isoxazol-5-amine|3-(4-bromophenyl)-1,2-oxazol-5-amine|3-(4-Bromophenyl)...SMILES: C1=CC(=CC=C1C2=NOC(=C2)N)BrInChIKey: RKWRDXQHQYRFCX-UHFFFAOYSA-NInChI: InChI=1S/C9H7BrN2O/c10-7-3-1-6(2-4-7)8-5-9(11)13-12-8/h1-5H,11H2
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3-(E-2-Cyanovinyl)phenylboronic acid (contains varying amounts of Anhydride)
Cas Number: 850568-53-5Formula: C9H8NBO2Molecular weight: 173Synonyms: 850568-53-5|(E)-(3-(2-Cyanovinyl)phenyl)boronic acid|3-(E-2-Cyanovinyl)phenylboronic acid|3-(3-Boron...SMILES: B(C1=CC(=CC=C1)C=CC#N)(O)OInChIKey: YDSLGHLJEJPWNC-DUXPYHPUSA-NInChI: InChI=1S/C9H8BNO2/c11-6-2-4-8-3-1-5-9(7-8)10(12)13/h1-5,7,12-13H/b4-2+
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tert-butyl trans-4-(hydroxymethyl)cyclohexanecarboxylate
Cas Number: 1943744-53-3Formula: C12H22O3Molecular weight: 214.3Synonyms: 1943744-53-3 | tert-butyl trans-4-(hydroxymethyl)cyclohexanecarboxylate | Rel-tert-butyl (1r,4r)-4-(...SMILES: CC(C)(C)OC(=O)C1CCC(CC1)COInChIKey: SBIFXCKFDSDRDL-UHFFFAOYSA-NInChI: InChI=1S/C12H22O3/c1-12(2,3)15-11(14)10-6-4-9(8-13)5-7-10/h9-10,13H,4-8H2,1-3H3
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trans-3-(aminomethyl)-1-methyl-cyclobutanol;hydrochloride
Cas Number: 2231664-53-0Synonyms: 3-(Aminomethyl)-1-methylcyclobutan-1-ol hydrochloride | 2231664-53-0 | 2173105-60-5 | trans-3-hydrox...SMILES: CC1(CC(C1)CN)O.ClInChIKey: ZFARZXPVUHKMIX-UHFFFAOYSA-NInChI: InChI=1S/C6H13NO.ClH/c1-6(8)2-5(3-6)4-7;/h5,8H,2-4,7H2,1H3;1H
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(4-Bromo-3-fluorophenyl)methanamine hydrochloride
Cas Number: 1214342-53-6Formula: C7H8BrClFNMolecular weight: 240.5Synonyms: (4-bromo-3-fluorophenyl)methanamine hydrochloride|1214342-53-6|(4-bromo-3-fluorophenyl)methanamine;h...SMILES: C1=CC(=C(C=C1CN)F)Br.ClInChIKey: YURPLAWBHIYAOX-UHFFFAOYSA-NInChI: InChI=1S/C7H7BrFN.ClH/c8-6-2-1-5(4-10)3-7(6)9;/h1-3H,4,10H2;1H
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3-fluorobicyclo[1.1.1]pentane-1-carboxylic acid
Cas Number: 146038-53-1Formula: C6H7FO2Molecular weight: 130.118Synonyms: 3-Fluorobicyclo[1.1.1]pentane-1-carboxylic acid|146038-53-1|Bicyclo[1.1.1]pentane-1-carboxylic acid,...SMILES: C1C2(CC1(C2)F)C(=O)OInChIKey: CQOUAQUBJPKQON-UHFFFAOYSA-NInChI: InChI=1S/C6H7FO2/c7-6-1-5(2-6,3-6)4(8)9/h1-3H2,(H,8,9)
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4-(4-Cyanophenyl)nicotinic acid
Cas Number: 1261943-53-6Formula: C13H8N2O2Molecular weight: 224.2Synonyms: 4-(4-CYANOPHENYL)NICOTINIC ACID|1261943-53-6|4-(4-cyanophenyl)pyridine-3-carboxylic acid|4-(4-Cyanop...SMILES: C1=CC(=CC=C1C#N)C2=C(C=NC=C2)C(=O)OInChIKey: JBDWRDZLMVIYDW-UHFFFAOYSA-NInChI: InChI=1S/C13H8N2O2/c14-7-9-1-3-10(4-2-9)11-5-6-15-8-12(11)13(16)17/h1-6,8H,(H,16,17)
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3-Amino-7-chloro-1,2,4-benzotriazine
Cas Number: 5423-53-0Formula: C7H5ClN4Molecular weight: 180.59Synonyms: 3-Amino-7-chloro-1,2,4-benzotriazine|5423-53-0|7-chloro-1,2,4-benzotriazin-3-amine|1,2,4-Benzotriazi...SMILES: C1=CC2=C(C=C1Cl)N=NC(=N2)NInChIKey: KTIMFFFWQOYBMI-UHFFFAOYSA-NInChI: InChI=1S/C7H5ClN4/c8-4-1-2-5-6(3-4)11-12-7(9)10-5/h1-3H,(H2,9,10,12)
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Ethyl 1-benzylpiperidine-3-carboxylate
Cas Number: 72551-53-2Formula: C15H21NO2Molecular weight: 247.3Synonyms: ethyl 1-benzylpiperidine-3-carboxylate|72551-53-2|1-benzylpiperidine-3-carboxylic acid ethyl ester|M...SMILES: CCOC(=O)C1CCCN(C1)CC2=CC=CC=C2InChIKey: CDMAVYOAEITWFQ-UHFFFAOYSA-NInChI: InChI=1S/C15H21NO2/c1-2-18-15(17)14-9-6-10-16(12-14)11-13-7-4-3-5-8-13/h3-5,7-8,14H,2,6,9-12H2,1H3
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3-oxaspiro[5.5]undecan-9-one
Cas Number: 1159280-53-1Formula: C10H16O2Molecular weight: 168.2328Synonyms: 3-OXASPIRO[5.5]UNDECAN-9-ONE|1159280-53-1|MFCD17013084|3-?oxaspiro[5.5]?undecan-?9-?one|SCHEMBL37334...SMILES: C1CC2(CCC1=O)CCOCC2InChIKey: OOKHKTHERWWYQI-UHFFFAOYSA-NInChI: InChI=1S/C10H16O2/c11-9-1-3-10(4-2-9)5-7-12-8-6-10/h1-8H2
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(4-Methyl-3-nitrophenyl)methanamine
Cas Number: 623155-53-3Formula: C8H10N2O2Molecular weight: 166.18Synonyms: (4-Methyl-3-nitrophenyl)methanamine|623155-53-3|4-METHYL-3-NITROBENZYLAMINE|1-(4-Methyl-3-nitropheny...SMILES: CC1=C(C=C(C=C1)CN)[N+](=O)[O-]InChIKey: SYGIBQOBTAYVCA-UHFFFAOYSA-NInChI: InChI=1S/C8H10N2O2/c1-6-2-3-7(5-9)4-8(6)10(11)12/h2-4H,5,9H2,1H3
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Boc-(+/-)-trans-4-(3-fluoro-phenyl)-pyrrolidine-3-carboxylic acid
Cas Number: 301226-53-9Formula: C16H20FNO4Molecular weight: 309.3Synonyms: 301226-53-9|trans-1-(tert-Butoxycarbonyl)-4-(3-fluorophenyl)pyrrolidine-3-carboxylic acid|BOC-TRANS-...SMILES: CC(C)(C)OC(=O)N1CC(C(C1)C(=O)O)C2=CC(=CC=C2)FInChIKey: NUVNFNVJYJQLRA-OLZOCXBDSA-NInChI: InChI=1S/C16H20FNO4/c1-16(2,3)22-15(21)18-8-12(13(9-18)14(19)20)10-5-4-6-11(17)7-10/h4-7,12-13H,8-9H2,1-3H3,(H,19,20)/t12-,13+/m1/s1
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tert-butyl 3-(2-ethoxy-2-oxoethyl)-3-hydroxyazetidine-1-carboxylate
Cas Number: 1823865-53-7Formula: C12H21NO5Molecular weight: 259.3Synonyms: tert-Butyl 3-(2-ethoxy-2-oxoethyl)-3-hydroxyazetidine-1-carboxylate | 1823865-53-7 | SCHEMBL18497293...SMILES: CCOC(=O)CC1(CN(C1)C(=O)OC(C)(C)C)OInChIKey: DZKBYAYNLABWHO-UHFFFAOYSA-NInChI: InChI=1S/C12H21NO5/c1-5-17-9(14)6-12(16)7-13(8-12)10(15)18-11(2,3)4/h16H,5-8H2,1-4H3
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1,3,2-Dioxathiolane 2,2-dioxide
Cas Number: 1072-53-3Formula: C2H4O4SMolecular weight: 124.12Synonyms: BRN 1237731 | CAS-1072-53-3 | ethosulfate | ethyl enesulfate | AKOS015855774 | AMY21937 | Glycol sul...SMILES: C1COS(=O)(=O)O1InChIKey: ZPFAVCIQZKRBGF-UHFFFAOYSA-NInChI: InChI=1S/C2H4O4S/c3-7(4)5-1-2-6-7/h1-2H2
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5-(oxetan-3-yloxy)pyridine-2-carboxylic acid
Cas Number: 1393330-53-4Formula: C9H9NO4Molecular weight: 195.17Synonyms: AKOS027390859 | 5-(Oxetan-3-yloxy)pyridine-2-carboxylicacid | 5-(Oxetan-3-yloxy)pyridine-2-carboxyli...SMILES: C1C(CO1)OC2=CN=C(C=C2)C(=O)OInChIKey: CNFWMQCBZFVFJW-UHFFFAOYSA-NInChI: InChI=1S/C9H9NO4/c11-9(12)8-2-1-6(3-10-8)14-7-4-13-5-7/h1-3,7H,4-5H2,(H,11,12)
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4-bromo-3-ethylpyridine hydrochloride
Cas Number: 1818847-53-8Formula: C7H9BrClNMolecular weight: 222.51Synonyms: 4-Bromo-3-ethylpyridine hydrochloride|1818847-53-8|4-Bromo-3-ethylpyridine HCl|4-bromo-3-ethylpyridi...SMILES: CCC1=C(C=CN=C1)Br.ClInChIKey: JSWPNVFJQWNVPX-UHFFFAOYSA-NInChI: InChI=1S/C7H8BrN.ClH/c1-2-6-5-9-4-3-7(6)8;/h3-5H,2H2,1H3;1H
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cis-3,4-difluoropiperidine hydrochloride
Cas Number: 1419101-53-3Synonyms: cis-3,4-Difluoropiperidine hydrochloride | 1419101-53-3 | cis-3,4-Difluoropiperidine HCl | (3R,4S)-3...SMILES: C1CNCC(C1F)F.ClInChIKey: MKMKCRCSQCCJJO-UYXJWNHNSA-NInChI: InChI=1S/C5H9F2N.ClH/c6-4-1-2-8-3-5(4)7;/h4-5,8H,1-3H2;1H/t4-,5+;/m0./s1
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1-(2,2,2-trifluoroethyl)azetidine-3-carboxylic acid
Cas Number: 1339115-53-5 EC Number: 841-762-1Formula: C6H8F3NO2Molecular weight: 183.13Synonyms: 1339115-53-5 | MFCD20282477 | A1-06905 | AS-78896 | AKOS013581876 | 1-(2,2,2-trifluoroethyl)azetidin...SMILES: C1C(CN1CC(F)(F)F)C(=O)OInChIKey: JNYQZTQYRYZPSA-UHFFFAOYSA-NInChI: InChI=1S/C6H8F3NO2/c7-6(8,9)3-10-1-4(2-10)5(11)12/h4H,1-3H2,(H,11,12)
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5-Bromo-2-fluoropyridin-3-ol
Cas Number: 1012084-53-5Formula: C5H3BrFNOMolecular weight: 192Synonyms: 5-Bromo-2-fluoropyridin-3-ol|1012084-53-5|5-Bromo-2-fluoro-3-hydroxypyridine|5-bromo-2-fluoro-3-pyri...SMILES: C1=C(C=NC(=C1O)F)BrInChIKey: SLLINPJLHURFNX-UHFFFAOYSA-NInChI: InChI=1S/C5H3BrFNO/c6-3-1-4(9)5(7)8-2-3/h1-2,9H
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2-Bromo-9-(2-naphthyl)-9H-carbazole
Cas Number: 1427316-53-7Formula: C22H14BrNMolecular weight: 372.27Synonyms: 2-Bromo-9-(2-naphthyl)-9H-carbazole | 2-bromo-9-(naphthalen-3-yl)-9H-carbazole | T70276 | B5051 | CH...SMILES: C1=CC=C2C=C(C=CC2=C1)N3C4=CC=CC=C4C5=C3C=C(C=C5)BrInChIKey: PYHCFFLUGHKAPZ-UHFFFAOYSA-NInChI: InChI=1S/C22H14BrN/c23-17-10-12-20-19-7-3-4-8-21(19)24(22(20)14-17)18-11-9-15-5-1-2-6-16(15)13-18/h1-14H
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EBE-A22
Cas Number: 229476-53-3Formula: C17H16BrN3O2Molecular weight: 374.23Synonyms: EBE-A22|229476-53-3|N-(3-bromophenyl)-6,7-dimethoxy-N-methylquinazolin-4-amine|CHEMBL447230|4-Quinaz...SMILES: CN(C1=CC(=CC=C1)Br)C2=NC=NC3=CC(=C(C=C32)OC)OCInChIKey: IPWGDOZPSOZFOD-UHFFFAOYSA-NInChI: InChI=1S/C17H16BrN3O2/c1-21(12-6-4-5-11(18)7-12)17-13-8-15(22-2)16(23-3)9-14(13)19-10-20-17/h4-10H,1-3H3
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