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Search results for: '132605-96-0'
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(R)-2-(((tert-Butoxycarbonyl)amino)methyl)-4-methylpentanoic acid
Cas Number: 132605-96-0Formula: C12H23NO4Molecular weight: 245.32SMILES: CC(C)CC(CNC(=O)OC(C)(C)C)C(=O)OInChIKey: WWKOREWJYZNXDX-SECBINFHSA-NInChI: InChI=1S/C12H23NO4/c1-8(2)6-9(10(14)15)7-13-11(16)17-12(3,4)5/h8-9H,6-7H2,1-5H3,(H,13,16)(H,14,15)/t9-/m1/s1
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1-hexanoyl-2-hydroxy-sn-glycero-3-phosphocholine
Cas Number: 58445-96-8Formula: C14H30NO7PMolecular weight: 355.364Synonyms: 58445-96-8|1-hexanoyl-sn-glycero-3-phosphocholine|L-ALPHA-LYSOPHOSPHATIDYLCHOLINE,CAPROYL|PC(6:0/0:0...SMILES: CCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OInChIKey: WDNDPXJAUNUOFK-CYBMUJFWSA-NInChI: InChI=1S/C14H30NO7P/c1-5-6-7-8-14(17)20-11-13(16)12-22-23(18,19)21-10-9-15(2,3)4/h13,16H,5-12H2,1-4H3/t13-/m1/s1
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3-Aminocyclopentanecarboxylic acid
Cas Number: 89614-96-0Formula: C6H11NO2Molecular weight: 129.2Synonyms: 3-Aminocyclopentanecarboxylic acid|89614-96-0|3-Aminocyclopentane-1-carboxylic acid|3-amino-cyclopen...SMILES: C1CC(CC1C(=O)O)NInChIKey: MLLSSTJTARJLHK-UHFFFAOYSA-NInChI: InChI=1S/C6H11NO2/c7-5-2-1-4(3-5)6(8)9/h4-5H,1-3,7H2,(H,8,9)
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3-(bromomethyl)-3-fluoro-pyrrolidine;hydrochloride
Cas Number: 2306268-96-0Synonyms: 2306268-96-0 | 3-(Bromomethyl)-3-fluoropyrrolidine hydrochloride | 3-(bromomethyl)-3-fluoro-pyrrolid...SMILES: C1CNCC1(CBr)F.ClInChIKey: DORLMZBQVLZHSE-UHFFFAOYSA-NInChI: InChI=1S/C5H9BrFN.ClH/c6-3-5(7)1-2-8-4-5;/h8H,1-4H2;1H
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Stearyl Stearate
Cas Number: 2778-96-3Formula: C36H72O2Molecular weight: 536.96Synonyms: STEARYL STEARATE|2778-96-3|Octadecyl Octadecanoate|Octadecyl stearate|Octadecanoic acid, octadecyl e...SMILES: CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCCInChIKey: NKBWPOSQERPBFI-UHFFFAOYSA-NInChI: InChI=1S/C36H72O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-35H2,1-2H3
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tert-butyl 2-(4-methoxycarbonylphenyl)pyrrolidine-1-carboxylate
Cas Number: 1243198-96-0Formula: C17H23NO4Molecular weight: 305.37Synonyms: tert-butyl 2-(4-methoxycarbonylphenyl)pyrrolidine-1-carboxylate | 1243198-96-0 | SCHEMBL1653727 | MF...SMILES: CC(C)(C)OC(=O)N1CCCC1C2=CC=C(C=C2)C(=O)OCInChIKey: WIAPYPPGIDQQPV-UHFFFAOYSA-NInChI: InChI=1S/C17H23NO4/c1-17(2,3)22-16(20)18-11-5-6-14(18)12-7-9-13(10-8-12)15(19)21-4/h7-10,14H,5-6,11H2,1-4H3
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5-bromo-4-chloro-6-(4-fluorophenyl)thieno[2,3-d]pyrimidine
Cas Number: 1799610-96-0Formula: C12H5BrClFN2SMolecular weight: 343.6Synonyms: 5-Bromo-4-chloro-6-(4-fluorophenyl)thieno[2,3-d]pyrimidine | 1799610-96-0 | SCHEMBL16815522 | TQR131...SMILES: C1=CC(=CC=C1C2=C(C3=C(S2)N=CN=C3Cl)Br)FInChIKey: HANITCXVWCBUEI-UHFFFAOYSA-NInChI: InChI=1S/C12H5BrClFN2S/c13-9-8-11(14)16-5-17-12(8)18-10(9)6-1-3-7(15)4-2-6/h1-5H
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Tricosanoic acid
Formula: C23H46O2Molecular weight: 354.61Synonyms: TRICOSANOIC ACID|2433-96-7|n-Tricosanoic acid|TRICOSANOICACID|Tricosylic acid|22FA|Tricosan-1-oic ac...SMILES: CCCCCCCCCCCCCCCCCCCCCCC(=O)OInChIKey: XEZVDURJDFGERA-UHFFFAOYSA-NInChI: InChI=1S/C23H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25/h2-22H2,1H3,(H,24,25)
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4-bromo-5-fluoro-1H-indole
Cas Number: 1227493-96-0Formula: C8H5NFBrMolecular weight: 214.03Synonyms: 4-bromo-5-fluoro-1H-indole | 1227493-96-0 | 4-BROMO-5-FLUOROINDOLE | SCHEMBL13065414 | AMY2147 | MFC...SMILES: C1=CC(=C(C2=C1NC=C2)Br)FInChIKey: CIRXFJXMJOVFMR-UHFFFAOYSA-NInChI: InChI=1S/C8H5BrFN/c9-8-5-3-4-11-7(5)2-1-6(8)10/h1-4,11H
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Cyclohexyl cyclohexanecarboxylate
Cas Number: 15840-96-7Formula: C13H22O2Molecular weight: 210.3Synonyms: Cyclohexyl cyclohexanecarboxylate|15840-96-7|Cyclohexanecarboxylic acid, cyclohexyl ester|MFCD205283...SMILES: C1CCC(CC1)C(=O)OC2CCCCC2InChIKey: VJCWGXGMXAVKJU-UHFFFAOYSA-NInChI: InChI=1S/C13H22O2/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2
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7-Acetyl-5-bromoindole
Cas Number: 1253789-74-0Formula: C10H8BrNOMolecular weight: 238.08Synonyms: 1253789-74-0 | 1-(5-bromo-1H-indol-7-yl)ethan-1-one | AKOS015834790 | 7-Acetyl-5-bromoindole, 96% | ...SMILES: CC(=O)C1=C2C(=CC(=C1)Br)C=CN2InChIKey: LPQKQTUKOZNLJQ-UHFFFAOYSA-NInChI: InChI=1S/C10H8BrNO/c1-6(13)9-5-8(11)4-7-2-3-12-10(7)9/h2-5,12H,1H3
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methyl 2-chloroquinazoline-6-carboxylate
Synonyms: METHYL 2-CHLOROQUINAZOLINE-6-CARBOXYLATE|1036755-96-0|MFCD17016011|Methyl2-chloroquinazoline-6-carbo...SMILES: COC(=O)C1=CC2=CN=C(N=C2C=C1)ClInChIKey: NURBZIINUBTMRI-UHFFFAOYSA-NInChI: InChI=1S/C10H7ClN2O2/c1-15-9(14)6-2-3-8-7(4-6)5-12-10(11)13-8/h2-5H,1H3
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Aloperine
Cas Number: 56293-29-9Formula: C15H24N2Molecular weight: 232.36Synonyms: (1R,2S,9R,10R)-3,15-DIAZATETRACYCLO[7.7.1.0(2),?.0(1)?,(1)?]HEPTADEC-7-ENE | Aloperine, 96% | Alop1 ...SMILES: C1CCN2CC3CC(C2C1)C=C4C3NCCC4InChIKey: SKOLRLSBMUGVOY-GBJTYRQASA-NInChI: InChI=1S/C15H24N2/c1-2-7-17-10-13-9-12(14(17)5-1)8-11-4-3-6-16-15(11)13/h8,12-16H,1-7,9-10H2/t12-,13+,14+,15+/m0/s1
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2-Benzylphenyl isocyanate
Cas Number: 146446-96-0Formula: C14H11NOMolecular weight: 209.24Synonyms: 2-Benzylphenyl isocyanate|146446-96-0|1-benzyl-2-isocyanatobenzene|2-benzylphenylisocyanate|Benzene,...SMILES: C1=CC=C(C=C1)CC2=CC=CC=C2N=C=OInChIKey: GLYMYAJKKMZFQT-UHFFFAOYSA-NInChI: InChI=1S/C14H11NO/c16-11-15-14-9-5-4-8-13(14)10-12-6-2-1-3-7-12/h1-9H,10H2
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(3-acetylsulfanyl-1-naphthyl) acetate
Cas Number: 2143010-96-0Formula: C14H12O3SMolecular weight: 260.31Synonyms: (3-acetylsulfanyl-1-naphthyl) acetate | 2143010-96-0 | (3-acetylsulfanylnaphthalen-1-yl) acetate | 3...SMILES: CC(=O)OC1=CC(=CC2=CC=CC=C21)SC(=O)CInChIKey: SJKMBYJMUXVKHO-UHFFFAOYSA-NInChI: InChI=1S/C14H12O3S/c1-9(15)17-14-8-12(18-10(2)16)7-11-5-3-4-6-13(11)14/h3-8H,1-2H3
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1-tert-butyl 3-methyl 3-fluoropyrrolidine-1,3-dicarboxylate
Cas Number: 942189-96-0Formula: C11H18FNO4Molecular weight: 247.266Synonyms: 942189-96-0|1-TERT-BUTYL 3-METHYL 3-FLUOROPYRROLIDINE-1,3-DICARBOXYLATE|Methyl 1-Boc-3-fluoropyrroli...SMILES: CC(C)(C)OC(=O)N1CCC(C1)(C(=O)OC)FInChIKey: WJXDMHSZPKIZKP-UHFFFAOYSA-NInChI: InChI=1S/C11H18FNO4/c1-10(2,3)17-9(15)13-6-5-11(12,7-13)8(14)16-4/h5-7H2,1-4H3
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3-Pentanone
Formula: C5H10OMolecular weight: 86.13Synonyms: 3-PENTANONE|Pentan-3-one|Diethyl ketone|96-22-0|Dimethylacetone|Methacetone|Propione|Ethyl ketone|Me...SMILES: CCC(=O)CCInChIKey: FDPIMTJIUBPUKL-UHFFFAOYSA-NInChI: InChI=1S/C5H10O/c1-3-5(6)4-2/h3-4H2,1-2H3
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Methyl trans-3-bromocyclobutane-1-carboxylate
Cas Number: 1523618-35-0Formula: C6H9BrO2Molecular weight: 193.04Synonyms: methyl 3-bromocyclobutane-1-carboxylate|4935-00-6|1523618-35-0|methyl trans-3-bromocyclobutane-1-car...SMILES: COC(=O)C1CC(C1)BrInChIKey: PXUHGFNZFJXRFN-UHFFFAOYSA-NInChI: InChI=1S/C6H9BrO2/c1-9-6(8)4-2-5(7)3-4/h4-5H,2-3H2,1H3
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azepane-4-carboxylic acid
Cas Number: 97164-96-0Formula: C7H13NO2Molecular weight: 143.186Synonyms: AZEPANE-4-CARBOXYLIC ACID|97164-96-0|HEXAHYDRO-1H-AZEPINE-4-CARBOXYLIC ACID|MFCD17015909|1H-AZEPINE-...SMILES: C1CC(CCNC1)C(=O)OInChIKey: BCVGGQNBSCMMPV-UHFFFAOYSA-NInChI: InChI=1S/C7H13NO2/c9-7(10)6-2-1-4-8-5-3-6/h6,8H,1-5H2,(H,9,10)
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3‐chloro‐1H‐indole
Cas Number: 16863-96-0Formula: C8H6ClNMolecular weight: 151.593Synonyms: 3-chloro-1H-indole|16863-96-0|3-Chloroindole|1H-indole, 3-chloro-|1H-Indole,3-chloro-|MFCD09250863|S...SMILES: C1=CC=C2C(=C1)C(=CN2)ClInChIKey: GVSMQKKMAYLKMM-UHFFFAOYSA-NInChI: InChI=1S/C8H6ClN/c9-7-5-10-8-4-2-1-3-6(7)8/h1-5,10H
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2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride
Cas Number: 1864061-96-0 EC Number: 868-278-3Synonyms: 2-methyl-2,9-diazaspiro[4.5]decane;dihydrochloride | DTXSID60857375 | 1864061-96-0 | MFCD26406956 | ...SMILES: CN1CCC2(C1)CCCNC2.Cl.ClInChIKey: JTCVGDHJMNBCEH-UHFFFAOYSA-NInChI: InChI=1S/C9H18N2.2ClH/c1-11-6-4-9(8-11)3-2-5-10-7-9;;/h10H,2-8H2,1H3;2*1H
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(3R,5S)-5-methylpiperidine-3-carboxylic acid
Cas Number: 1638743-96-0Formula: C7H13NO2Molecular weight: 143.19Synonyms: (3R,5S)-5-methylpiperidine-3-carboxylic acid | 1638743-96-0 | rac-(3r,5s)-5-methylpiperidine-3-carbo...SMILES: CC1CC(CNC1)C(=O)OInChIKey: CBDSIHCOUDRMMA-NTSWFWBYSA-NInChI: InChI=1S/C7H13NO2/c1-5-2-6(7(9)10)4-8-3-5/h5-6,8H,2-4H2,1H3,(H,9,10)/t5-,6+/m0/s1
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2-[2-(2-Chloroethoxy)ethoxy]ethanol
Cas Number: 5197-62-6Formula: C6H13ClO3Molecular weight: 168.62Synonyms: NSC2636 | EN300-134537 | AKOS006220767 | NSC 2636 | EINECS 225-984-0 | Ethanol, 2-(2-(2-chloroethoxy...SMILES: C(COCCOCCCl)OInChIKey: KECMLGZOQMJIBM-UHFFFAOYSA-NInChI: InChI=1S/C6H13ClO3/c7-1-3-9-5-6-10-4-2-8/h8H,1-6H2
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A 412997 dihydrochloride
Cas Number: 1347744-96-0Formula: C19H23N3O•2HClMolecular weight: 382.33Synonyms: HY-103424 | 2-(4-(Pyridin-2-yl)piperidin-1-yl)-N-(m-tolyl)acetamidedihydrochloride | A 412997 dihydr...SMILES: CC1=CC(=CC=C1)NC(=O)CN2CCC(CC2)C3=CC=CC=N3.Cl.ClInChIKey: KIGNSSHMCNBHQX-UHFFFAOYSA-NInChI: InChI=1S/C19H23N3O.2ClH/c1-15-5-4-6-17(13-15)21-19(23)14-22-11-8-16(9-12-22)18-7-2-3-10-20-18;;/h2-7,10,13,16H,8-9,11-12,14H2,1H3,(H,21,23);2*1H
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