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Aryl alkyl ketones
Description:
Ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group.
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1-(4-Chloropyridin-2-yl)propan-1-oneCas Number: 896139-36-9 Compound CID: 53402879Formula: C8H8ClNO Molecular Weight: 169.61IUPAC Name: 1-(4-chloropyridin-2-yl)propan-1-oneSMILES: CCC(=O)C1=NC=CC(=C1)ClInChIKey: BYWBPEJZCDHZJO-UHFFFAOYSA-NInChI: InChI=1S/C8H8ClNO/c1-2-8(11)7-5-6(9)3-4-10-7/h3-5H,2H2,1H3 -
1-(5-Bromo-4-chlorothiophen-2-yl)ethan-1-oneCas Number: 123418-66-6 Compound CID: 46911882Formula: C6H4BrClOS Molecular Weight: 239.52IUPAC Name: 1-(5-bromo-4-chlorothiophen-2-yl)ethanoneSMILES: CC(=O)C1=CC(=C(S1)Br)ClInChIKey: FSZXWJHCTQQQGZ-UHFFFAOYSA-NInChI: InChI=1S/C6H4BrClOS/c1-3(9)5-2-4(8)6(7)10-5/h2H,1H3
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1-(4-METHYLOXAZOL-5-YL)ETHAN-1-ONECas Number: 23012-19-3 Compound CID: 11029839Formula: C6H7NO2 Molecular Weight: 125.13IUPAC Name: 1-(4-methyl-1,3-oxazol-5-yl)ethanoneSMILES: CC1=C(OC=N1)C(=O)CInChIKey: BYBRWPKBEPJABL-UHFFFAOYSA-NInChI: InChI=1S/C6H7NO2/c1-4-6(5(2)8)9-3-7-4/h3H,1-2H3
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1-(4-methoxypyridin-2-yl)ethanoneCas Number: 59576-28-2 Compound CID: 21816816Formula: C8H9NO2 Molecular Weight: 151.17IUPAC Name: 1-(4-methoxypyridin-2-yl)ethanoneSMILES: CC(=O)C1=NC=CC(=C1)OCInChIKey: VYESAHFYMWMHMN-UHFFFAOYSA-NInChI: InChI=1S/C8H9NO2/c1-6(10)8-5-7(11-2)3-4-9-8/h3-5H,1-2H3
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1-(4，6-Dimethylpyridin-2-yl)ethanoneCas Number: 59576-31-7 Compound CID: 23003513Formula: C9H11NO Molecular Weight: 149.19IUPAC Name: 1-(4,6-dimethylpyridin-2-yl)ethanoneSMILES: CC1=CC(=NC(=C1)C(=O)C)CInChIKey: IWZFETYQIYPLIE-UHFFFAOYSA-NInChI: InChI=1S/C9H11NO/c1-6-4-7(2)10-9(5-6)8(3)11/h4-5H,1-3H3
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1-(5-(4，4，5，5-Tetramethyl-1，3，2-dioxaborolan-2-yl)pyridin-2-yl)ethanoneCas Number: 741709-59-1 Compound CID: 53398535Formula: C13H18BNO3 Molecular Weight: 247.1IUPAC Name: 1-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]ethanoneSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)C(=O)CInChIKey: ISRQZHALMLGEGD-UHFFFAOYSA-NInChI: InChI=1S/C13H18BNO3/c1-9(16)11-7-6-10(8-15-11)14-17-12(2,3)13(4,5)18-14/h6-8H,1-5H3
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1-(5-Bromo-4-methylthiophen-2-yl)ethanoneCas Number: 859199-06-7 Compound CID: 45480353IUPAC Name: 1-(5-bromo-4-methylthiophen-2-yl)ethanoneSMILES: CC1=C(SC(=C1)C(=O)C)BrInChIKey: KQZYEQHMHCHZKP-UHFFFAOYSA-NInChI: InChI=1S/C7H7BrOS/c1-4-3-6(5(2)9)10-7(4)8/h3H,1-2H3
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1-(5-Bromofuran-2-yl)ethanoneCas Number: 3199-50-6 Compound CID: 11030585Formula: C6H5BrO2 Molecular Weight: 189.01IUPAC Name: 1-(5-bromofuran-2-yl)ethanoneSMILES: CC(=O)C1=CC=C(O1)BrInChIKey: CASNGOWLOZSVMA-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrO2/c1-4(8)5-2-3-6(7)9-5/h2-3H,1H3
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1-(3,5-Dimethyl-1H-pyrazol-4-yl)ethanoneCas Number: 1123-48-4 Compound CID: 239664Formula: C7H10N2O Molecular Weight: 138.16IUPAC Name: 1-(3,5-dimethyl-1H-pyrazol-4-yl)ethanoneSMILES: CC1=C(C(=NN1)C)C(=O)CInChIKey: XVFAWYIDDRHPNV-UHFFFAOYSA-NInChI: InChI=1S/C7H10N2O/c1-4-7(6(3)10)5(2)9-8-4/h1-3H3,(H,8,9)
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1-(3-Methylisoxazol-5-yl)ethanoneCas Number: 55086-61-8 Compound CID: 13001394IUPAC Name: 1-(3-methyl-1,2-oxazol-5-yl)ethanoneSMILES: CC1=NOC(=C1)C(=O)CInChIKey: MOBMLOWIGFJSCP-UHFFFAOYSA-NInChI: InChI=1S/C6H7NO2/c1-4-3-6(5(2)8)9-7-4/h3H,1-2H3
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1-(3-Chloropyridin-4-yl)ethanoneCas Number: 78790-82-6 Compound CID: 12742467Formula: C7H6ClNO Molecular Weight: 155.58IUPAC Name: 1-(3-chloropyridin-4-yl)ethanoneSMILES: CC(=O)C1=C(C=NC=C1)ClInChIKey: USENXBJIUNFKAX-UHFFFAOYSA-NInChI: InChI=1S/C7H6ClNO/c1-5(10)6-2-3-9-4-7(6)8/h2-4H,1H3
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1-(2，6-Dimethylpyridin-3-yl)ethanoneCas Number: 1721-25-1 Compound CID: 13328107Formula: C9H11NO Molecular Weight: 149.19IUPAC Name: 1-(2,6-dimethylpyridin-3-yl)ethanoneSMILES: CC1=NC(=C(C=C1)C(=O)C)CInChIKey: QICFGQJIWDJROU-UHFFFAOYSA-NInChI: InChI=1S/C9H11NO/c1-6-4-5-9(8(3)11)7(2)10-6/h4-5H,1-3H3
