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Search results for: '3967-54-2'
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4-Chloro-1,3-dioxolan-2-one
Cas Number: 3967-54-2Formula: C3H3ClO3Molecular weight: 122.5Synonyms: 4-Chloro-1,3-dioxolan-2-one|3967-54-2|Chloroethylene carbonate|1,3-Dioxolan-2-one, 4-chloro-|NSC7444...SMILES: C1C(OC(=O)O1)ClInChIKey: OYOKPDLAMOMTEE-UHFFFAOYSA-NInChI: InChI=1S/C3H3ClO3/c4-2-1-6-3(5)7-2/h2H,1H2
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IM 54 (2-(1H-Indol-3-yl)-3-pentylamino-maleimide)
Cas Number: 861891-50-1Formula: C19H23N3O2Molecular weight: 325.41Synonyms: IM-54, >=98% (HPLC) | 1-methyl-3-(1-methyl-1H-indol-3-yl)-4-(pentylamino)-1H-pyrrole-2,5-dione; Necr...SMILES: CCCCCNC1=C(C(=O)N(C1=O)C)C2=CN(C3=CC=CC=C32)CInChIKey: SGLOMINNEBLJFF-UHFFFAOYSA-NInChI: InChI=1S/C19H23N3O2/c1-4-5-8-11-20-17-16(18(23)22(3)19(17)24)14-12-21(2)15-10-7-6-9-13(14)15/h6-7,9-10,12,20H,4-5,8,11H2,1-3H3
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3-Acetamidobenzoic Acid
Cas Number: 587-48-4Formula: C9H9NO3Molecular weight: 179.18Synonyms: A0012 | EINECS 209-600-9 | D88199 | MFCD00013983 | m-Acetamino benzoic acid | m-Acetylaminobenzoesau...SMILES: CC(=O)NC1=CC=CC(=C1)C(=O)OInChIKey: RGDPZMQZWZMONQ-UHFFFAOYSA-NInChI: InChI=1S/C9H9NO3/c1-6(11)10-8-4-2-3-7(5-8)9(12)13/h2-5H,1H3,(H,10,11)(H,12,13)
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Ethyl 4-tert-butylbenzoylformate
Cas Number: 80120-36-1Formula: C14H18O3Molecular weight: 234.3Synonyms: FS-3967 | Ethyl 2-(4-(tert-butyl)phenyl)-2-oxoacetate | FT-0625908 | Ethyl 4-tert-butylbenzoylformat...SMILES: CCOC(=O)C(=O)C1=CC=C(C=C1)C(C)(C)CInChIKey: VQDPLASXAHWKJX-UHFFFAOYSA-NInChI: InChI=1S/C14H18O3/c1-5-17-13(16)12(15)10-6-8-11(9-7-10)14(2,3)4/h6-9H,5H2,1-4H3
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2-Hydrazinobenzothiazole
Cas Number: 615-21-4Formula: C7H7N3SMolecular weight: 165.21Synonyms: WLN: T56 BN DSJ CMZ | STK394984 | Benzothiazol-2-yl-hydrazine | IDO1IN1 | IDO1-IN-1 | USAF EK-3967 |...SMILES: C1=CC=C2C(=C1)N=C(S2)NNInChIKey: JYSUYJCLUODSLN-UHFFFAOYSA-NInChI: InChI=1S/C7H7N3S/c8-10-7-9-5-3-1-2-4-6(5)11-7/h1-4H,8H2,(H,9,10)
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C.I. Basic Blue 54
Cas Number: 38901-83-6Formula: C17H19N4OS⁺Molecular weight: 327.4Synonyms: Basic Blue 54 | C.I. Basic Blue 54 | 4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N,...SMILES: C[N+]1=C(SC2=C1C=CC(=C2)OC)N=NC3=CC=C(C=C3)N(C)CInChIKey: WVUKFQBBZVBJRZ-UHFFFAOYSA-NInChI: InChI=1S/C17H19N4OS/c1-20(2)13-7-5-12(6-8-13)18-19-17-21(3)15-10-9-14(22-4)11-16(15)23-17/h5-11H,1-4H3/q+1
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3,4-Dichloro-2-fluorobenzaldehyde
Cas Number: 1349718-54-2Formula: C7H3Cl2FOMolecular weight: 193.00Synonyms: 3,4-Dichloro-2-fluorobenzaldehyde|1349718-54-2|SCHEMBL6904097|DTXSID101291186|MFCD19686189|AKOS02744...SMILES: C1=CC(=C(C(=C1C=O)F)Cl)ClInChIKey: BAJUBGNFUBFAEF-UHFFFAOYSA-NInChI: InChI=1S/C7H3Cl2FO/c8-5-2-1-4(3-11)7(10)6(5)9/h1-3H
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8-bromo-2-ethylsulfanyl-6-methyl-chromen-4-one
Cas Number: 2715284-54-9Formula: C12H11O2SBrMolecular weight: 299.18Synonyms: 8-bromo-2-ethylsulfanyl-6-methyl-chromen-4-one | 2715284-54-9 | SCHEMBL23887012 | F90000SMILES: CCSC1=CC(=O)C2=C(O1)C(=CC(=C2)C)BrInChIKey: RTHOAGMXHRPCLY-UHFFFAOYSA-NInChI: InChI=1S/C12H11BrO2S/c1-3-16-11-6-10(14)8-4-7(2)5-9(13)12(8)15-11/h4-6H,3H2,1-2H3
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4-bromo-1,5-dimethyl-naphthalene
Cas Number: 15095-54-2Formula: C12H11BrMolecular weight: 235.12Synonyms: 4-bromo-1,5-dimethyl-naphthalene | 15095-54-2 | 4-bromo-1,5-dimethylnaphthalene | SB73766 | D96891SMILES: CC1=C2C(=CC=C1)C(=CC=C2Br)CInChIKey: XTBNCFCOYAFCIB-UHFFFAOYSA-NInChI: InChI=1S/C12H11Br/c1-8-6-7-11(13)12-9(2)4-3-5-10(8)12/h3-7H,1-2H3
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5-chloro-4-fluoro-pyridin-2-amine
Cas Number: 1393574-54-3Formula: C5H4N2FClMolecular weight: 146.55Synonyms: 5-CHLORO-4-FLUOROPYRIDIN-2-AMINE | 1393574-54-3 | SCHEMBL20772247 | MFCD22547000 | AB82981 | DS-1996...SMILES: C1=C(C(=CN=C1N)Cl)FInChIKey: XZOCIXDBZWPVMX-UHFFFAOYSA-NInChI: InChI=1S/C5H4ClFN2/c6-3-2-9-5(8)1-4(3)7/h1-2H,(H2,8,9)
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5-(Dichloromethyl)-3-(3-nitrophenyl)-1,2,4-oxadiazole
Cas Number: 905107-54-2Formula: C9H5Cl2N3O3Molecular weight: 274.1Synonyms: 5-(DICHLOROMETHYL)-3-(3-NITROPHENYL)-1,2,4-OXADIAZOLE|905107-54-2|DTXSID50674977|MFCD01883255|AKOS01...SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C2=NOC(=N2)C(Cl)ClInChIKey: JYOMJJFPJLSWKA-UHFFFAOYSA-NInChI: InChI=1S/C9H5Cl2N3O3/c10-7(11)9-12-8(13-17-9)5-2-1-3-6(4-5)14(15)16/h1-4,7H
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3-Methyloxetan-2-one
Cas Number: 1823-54-7Formula: C4H6O2Molecular weight: 86.09Synonyms: 3-methyloxetan-2-one|1823-54-7|2-oxetanone, 3-methyl-|alpha-methyl-beta-propiolactone|DTXSID50436759...SMILES: CC1COC1=OInChIKey: NYBXFCLDEATPCM-UHFFFAOYSA-NInChI: InChI=1S/C4H6O2/c1-3-2-6-4(3)5/h3H,2H2,1H3
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4-bromo-1-methyl-3-(pyrrolidin-1-yl)-1H-pyrazole
Cas Number: 1619993-54-2Formula: C8H12BrN3Molecular weight: 230.11Synonyms: 4-bromo-1-methyl-3-(pyrrolidin-1-yl)-1H-pyrazole | 1619993-54-2 | SCHEMBL15886129 | MFCD30803169 | D...SMILES: CN1C=C(C(=N1)N2CCCC2)BrInChIKey: ZPXFVXRDZXVHLE-UHFFFAOYSA-NInChI: InChI=1S/C8H12BrN3/c1-11-6-7(9)8(10-11)12-4-2-3-5-12/h6H,2-5H2,1H3
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2,4,6-Tris(dimethylaminomethyl)phenol
Formula: C15H27N3OMolecular weight: 265.39Synonyms: 90-72-2|2,4,6-Tris(dimethylaminomethyl)phenol|2,4,6-Tris((dimethylamino)methyl)phenol|2,4,6-Tris[(di...SMILES: CN(C)CC1=CC(=C(C(=C1)CN(C)C)O)CN(C)CInChIKey: AHDSRXYHVZECER-UHFFFAOYSA-NInChI: InChI=1S/C15H27N3O/c1-16(2)9-12-7-13(10-17(3)4)15(19)14(8-12)11-18(5)6/h7-8,19H,9-11H2,1-6H3
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2-methyl-2-(1,2,3,6-tetrahydropyridin-4-yl)propan-1-ol hydrochloride
Cas Number: 157874-54-9Formula: C9H17NOMolecular weight: 155.24Synonyms: 157874-54-9|2-Methyl-2-(1,2,3,6-tetrahydropyridin-4-yl)propan-1-ol|DTXSID901231015|F76405|1,2,3,6-Te...SMILES: CC(C)(CO)C1=CCNCC1InChIKey: PNRJDMTUVJUUJT-UHFFFAOYSA-NInChI: InChI=1S/C9H17NO/c1-9(2,7-11)8-3-5-10-6-4-8/h3,10-11H,4-7H2,1-2H3
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2-azabicyclo[3.1.1]heptane hydrochloride
Cas Number: 2171280-54-7Synonyms: 2-Azabicyclo[3.1.1]heptane hydrochloride | 2171280-54-7 | (1r,5s)-2-azabicyclo[3.1.1]heptane hydroch...SMILES: C1CNC2CC1C2.ClInChIKey: LJXVTNBUFMWFLM-UHFFFAOYSA-NInChI: InChI=1S/C6H11N.ClH/c1-2-7-6-3-5(1)4-6;/h5-7H,1-4H2;1H
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GPi 688
Cas Number: 918902-32-6Formula: C19H18ClN3O4SMolecular weight: 419.88Synonyms: 2-Chloro-N-[1-[(2R)-2,3-dihydroxypropyl]-1,2,3,4-tetrahydro-2-oxo-3-quinolinyl]-6H-thieno[2,3-b]pyrr...SMILES: C1C(C(=O)N(C2=CC=CC=C21)CC(CO)O)NC(=O)C3=CC4=C(N3)SC(=C4)ClInChIKey: UICNBXVDHCBKCE-PUODRLBUSA-NInChI: InChI=1S/C19H18ClN3O4S/c20-16-7-11-6-13(22-18(11)28-16)17(26)21-14-5-10-3-1-2-4-15(10)23(19(14)27)8-12(25)9-24/h1-4,6-7,12,14,22,24-25H,5,8-9H2,(H,21,26)/t12-,14?/m1/s1
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methyl 2-(tert-butoxycarbonylamino)-3-(1-methylpyrazol-4-yl)prop-2-enoate
Cas Number: 2276666-54-5Formula: C13H19N3O4Molecular weight: 281.31Synonyms: E83506 | METHYL 2-((TERT-BUTOXYCARBONYL)AMINO)-3-(1-METHYL-1H-PYRAZOL-4-YL)ACRYLATE | 2276666-54-5SMILES: CC(C)(C)OC(=O)NC(=CC1=CN(N=C1)C)C(=O)OCInChIKey: OMEZHZHWPBLKHK-UHFFFAOYSA-NInChI: InChI=1S/C13H19N3O4/c1-13(2,3)20-12(18)15-10(11(17)19-5)6-9-7-14-16(4)8-9/h6-8H,1-5H3,(H,15,18)
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1-bromo-2-(cyclopropoxy)-4-nitro-benzene
Cas Number: 1243401-54-8Formula: C9H8NO3BrMolecular weight: 258.07Synonyms: 1-bromo-2-(cyclopropoxy)-4-nitro-benzene | 1243401-54-8 | 1-BROMO-2-CYCLOPROPOXY-4-NITROBENZENE | st...SMILES: C1CC1OC2=C(C=CC(=C2)[N+](=O)[O-])BrInChIKey: ILCJNKRGLZLRMV-UHFFFAOYSA-NInChI: InChI=1S/C9H8BrNO3/c10-8-4-1-6(11(12)13)5-9(8)14-7-2-3-7/h1,4-5,7H,2-3H2
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ETHYL CYCLOPENTYLACETATE
Cas Number: 18322-54-8Formula: C9H16O2Molecular weight: 156.227Synonyms: Ethyl 2-cyclopentylacetate|18322-54-8|ethyl cyclopentylacetate|Cyclopentaneacetic acid, ethyl ester|...SMILES: CCOC(=O)CC1CCCC1InChIKey: DBSADESEDBCPFO-UHFFFAOYSA-NInChI: InChI=1S/C9H16O2/c1-2-11-9(10)7-8-5-3-4-6-8/h8H,2-7H2,1H3
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2-(Dimethylamino)acetaldehyde hydrochloride
Cas Number: 125969-54-2Formula: C4H10ClNOMolecular weight: 123.58Synonyms: 125969-54-2|2-(Dimethylamino)acetaldehyde hydrochloride|2-(dimethylamino)acetaldehyde;hydrochloride|...SMILES: CN(C)CC=O.ClInChIKey: VUFMJROCMFQILX-UHFFFAOYSA-NInChI: InChI=1S/C4H9NO.ClH/c1-5(2)3-4-6;/h4H,3H2,1-2H3;1H
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4-(trifluoromethoxy)pyridin-2-amine
Cas Number: 1206980-54-2 EC Number: 849-135-4Formula: C6H5F3N2OMolecular weight: 178.11Synonyms: 4-(Trifluoromethoxy)pyridin-2-amine | SCHEMBL23213556 | EN300-378139 | 4-(Trifluoromethoxy)-2-pyridi...SMILES: C1=CN=C(C=C1OC(F)(F)F)NInChIKey: OOTFIRIPQWSBKK-UHFFFAOYSA-NInChI: InChI=1S/C6H5F3N2O/c7-6(8,9)12-4-1-2-11-5(10)3-4/h1-3H,(H2,10,11)
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2 Citations 
