Chemical Biology Tools
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Methyl 3-bromo-4-hydroxybenzoateCas#: 29415-97-2 Compound CID: 4778958Formula: C8H7BrO3 Molecular Weight: 231.05IUPAC Name: methyl 3-bromo-4-hydroxybenzoateSMILES: COC(=O)C1=CC(=C(C=C1)O)BrInChIKey: RKUNSPWAQIUGEZ-UHFFFAOYSA-NInChI: InChI=1S/C8H7BrO3/c1-12-8(11)5-2-3-7(10)6(9)4-5/h2-4,10H,1H3Synonyms: METHYL 3-BROMO-4-HYDROXYBENZOATE|29415-97-2|Benzoic acid, 3-bromo-4-hydroxy-, methyl ester|methyl 3-bromo-4-hydroxy-b...
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6-Chloroindole-3-carboxaldehydeCas#: 703-82-2 Compound CID: 12614669Formula: C9H6ClNO Molecular Weight: 179.6IUPAC Name: 6-chloro-1H-indole-3-carbaldehydeSMILES: C1=CC2=C(C=C1Cl)NC=C2C=OInChIKey: CTNIXLBHXMSZKL-UHFFFAOYSA-NInChI: InChI=1S/C9H6ClNO/c10-7-1-2-8-6(5-12)4-11-9(8)3-7/h1-5,11HSynonyms: 6-chloro-1H-indole-3-carbaldehyde|703-82-2|6-Chloroindole-3-carboxaldehyde|C9H6ClNO|6-CHLORO-3-FORMYLINDOLE|6-chloro-...
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Silica gelCas#: 112926-00-8 Compound CID: 24261Formula: mSiO2·nH2OIUPAC Name: dioxosilaneSMILES: O=[Si]=OInChIKey: VYPSYNLAJGMNEJ-UHFFFAOYSA-NInChI: InChI=1S/O2Si/c1-3-2Synonyms: SILICON DIOXIDE|Silica|Quartz|Dioxosilane|7631-86-9|Silica gel|Cristobalite|14808-60-7|Silicic anhydride|Tridymite|Sa...
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7-MethylisatinCas#: 1127-59-9 Compound CID: 14313Formula: C9H7NO2 Molecular Weight: 161.162IUPAC Name: 7-methyl-1H-indole-2,3-dioneSMILES: CC1=C2C(=CC=C1)C(=O)C(=O)N2InChIKey: UEHZKEABUOAZSH-UHFFFAOYSA-NInChI: InChI=1S/C9H7NO2/c1-5-3-2-4-6-7(5)10-9(12)8(6)11/h2-4H,1H3,(H,10,11,12)Synonyms: DTXSID7074456 | 1H-Indole-2,3-dione, 7-methyl-; | NSC3161 | NSC-3161 | 7-methyl-2,3-dihydro-1H-indole-2,3-dione | Isa...
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Silica gelCas#: 112926-00-8 Compound CID: 24261Formula: mSiO2·nH2OIUPAC Name: dioxosilaneSMILES: O=[Si]=OInChIKey: VYPSYNLAJGMNEJ-UHFFFAOYSA-NInChI: InChI=1S/O2Si/c1-3-2Synonyms: SILICON DIOXIDE|Silica|Quartz|Dioxosilane|7631-86-9|Silica gel|Cristobalite|14808-60-7|Silicic anhydride|Tridymite|Sa...
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Silica gel ICas#: 112926-00-8 Compound CID: 24261Formula: mSiO2·nH2OIUPAC Name: dioxosilaneSMILES: O=[Si]=OInChIKey: VYPSYNLAJGMNEJ-UHFFFAOYSA-NInChI: InChI=1S/O2Si/c1-3-2Synonyms: SILICON DIOXIDE|Silica|Quartz|Dioxosilane|7631-86-9|Silica gel|Cristobalite|14808-60-7|Silicic anhydride|Tridymite|Sa...
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N-Boc-1H-pyrazole-4-boronic acid (contains varying amounts of Anhydride)Cas#: 947533-31-5 Compound CID: 46739812Formula: C8H13BN2O4 Molecular Weight: 212.01IUPAC Name: [3,5-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazol-4-yl]boronic acidSMILES: B(C1=C(N(N=C1C)C(=O)OC(C)(C)C)C)(O)OInChIKey: QOJROSVHDGVEAI-UHFFFAOYSA-NInChI: InChI=1S/C10H17BN2O4/c1-6-8(11(15)16)7(2)13(12-6)9(14)17-10(3,4)5/h15-16H,1-5H3Synonyms: Y10752 | [3,5-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrazol-4-yl]boronic acid | 1-Boc-3,5-dimethyl-1H-pyrazol-...
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N-Boc-ethylenediamine hydrochlorideCas#: 79513-35-2 Compound CID: 187200Formula: C7H16N2O2 • HCl Molecular Weight: 196.68IUPAC Name: tert-butyl N-(2-aminoethyl)carbamate;hydrochlorideSMILES: CC(C)(C)OC(=O)NCCN.ClInChIKey: XUHJJLCKXZTUJN-UHFFFAOYSA-NInChI: InChI=1S/C7H16N2O2.ClH/c1-7(2,3)11-6(10)9-5-4-8;/h4-5,8H2,1-3H3,(H,9,10);1HSynonyms: XUHJJLCKXZTUJN-UHFFFAOYSA-N | tert-butyl N-(2-aminoethyl)carbamate;hydrochloride | N-Boc-ethylenediamine hydrochlorid...
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Ethyl 3-(2-thienyl)-1H-pyrazole-5-carboxylateCas#: 121195-03-7 Compound CID: 2736478Formula: C10H10N2O2S Molecular Weight: 222.26IUPAC Name: ethyl 5-thiophen-2-yl-1H-pyrazole-3-carboxylateSMILES: CCOC(=O)C1=NNC(=C1)C2=CC=CS2InChIKey: NTCRDZSJYGZRIE-UHFFFAOYSA-NInChI: InChI=1S/C10H10N2O2S/c1-2-14-10(13)8-6-7(11-12-8)9-4-3-5-15-9/h3-6H,2H2,1H3,(H,11,12)Synonyms: 121195-03-7|ethyl 5-thien-2-yl-1H-pyrazole-3-carboxylate|ethyl 5-(2-thienyl)pyrazole-3-carboxylate|ethyl 3-(thiophen-...
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Ethyl 3-(4-bromophenyl)propionateCas#: 40640-98-0 Compound CID: 12731927Formula: C11H13BrO2 Molecular Weight: 257.12IUPAC Name: ethyl 3-(4-bromophenyl)propanoateSMILES: CCOC(=O)CCC1=CC=C(C=C1)BrInChIKey: STMHGPFYLQOGJD-UHFFFAOYSA-NInChI: InChI=1S/C11H13BrO2/c1-2-14-11(13)8-5-9-3-6-10(12)7-4-9/h3-4,6-7H,2,5,8H2,1H3Synonyms: ethyl 3-(4-bromophenyl)propanoate|40640-98-0|3-(4-Bromophenyl)propionic acid ethyl ester|Benzenepropanoic acid, 4-bro...
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Ethyl 3-oxocyclobutanecarboxylate, 97%Cas#: 87121-89-9 Compound CID: 22467070Formula: C7H10O3 Molecular Weight: 142.16IUPAC Name: ethyl 3-oxocyclobutane-1-carboxylateSMILES: CCOC(=O)C1CC(=O)C1InChIKey: BXBRFSMPBOTZHJ-UHFFFAOYSA-NInChI: InChI=1S/C7H10O3/c1-2-10-7(9)5-3-6(8)4-5/h5H,2-4H2,1H3Synonyms: 3-ethoxycarbonyl-1-cyclobutanone | Cyclobutanecarboxylic acid, 3-oxo-, ethyl ester | BCP34597 | FT-0657369 | SCHEMBL8...
