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Boronic acid esters
Description:
Compounds comprising the boronic acid ester functional group RN(X)OR' (R,R'=alkyl, aryl; X= any O, N, Hal residue).
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tert-butyl-N-[2-(4，4，5，5-tetramethyl-1，3，2-dioxaborolan-2-yl)allyl]carbamateCas Number: 1202794-01-1 Compound CID: 53329567Formula: C14H26BNO4 Molecular Weight: 283.17IUPAC Name: tert-butyl N-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]carbamateSMILES: B1(OC(C(O1)(C)C)(C)C)C(=C)CNC(=O)OC(C)(C)CInChIKey: QACWDBPHSRQMNX-UHFFFAOYSA-NInChI: InChI=1S/C14H26BNO4/c1-10(9-16-11(17)18-12(2,3)4)15-19-13(5,6)14(7,8)20-15/h1,9H2,2-8H3,(H,16,17) -
5-(4，4，5，5-Tetramethyl-1，3，2-dioxaborolan-2-yl)furan-2-carbonitrileCas Number: 1111096-21-9Formula: C11H14BNO3 Molecular Weight: 219.04SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=C(O2)C#NInChIKey: FJXFCIJNLDIHNE-UHFFFAOYSA-NInChI: InChI=1S/C11H14BNO3/c1-10(2)11(3,4)16-12(15-10)9-6-5-8(7-13)14-9/h5-6H,1-4H3
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2-(cyclopentylidenemethyl)-4，4，5，5-tetramethyl-1，3，2-dioxaborolaneIUPAC Name: 2-(cyclopentylidenemethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneSMILES: B1(OC(C(O1)(C)C)(C)C)C=C2CCCC2InChIKey: HMMQKSRJXWCQNW-UHFFFAOYSA-NInChI: InChI=1S/C12H21BO2/c1-11(2)12(3,4)15-13(14-11)9-10-7-5-6-8-10/h9H,5-8H2,1-4H3
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2-Isobutyl-4，4，5，5-tetramethyl-1，3，2-dioxaborolaneCas Number: 67562-20-3 Compound CID: 13491253Formula: C10H21BO2 Molecular Weight: 184.09IUPAC Name: 4,4,5,5-tetramethyl-2-(2-methylpropyl)-1,3,2-dioxaborolaneSMILES: B1(OC(C(O1)(C)C)(C)C)CC(C)CInChIKey: FHQMPOBQBLDZJE-UHFFFAOYSA-NInChI: InChI=1S/C10H21BO2/c1-8(2)7-11-12-9(3,4)10(5,6)13-11/h8H,7H2,1-6H3
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2-Cycloheptyl-4，4，5，5-tetramethyl-1，3，2-dioxaborolaneCas Number: 931583-43-6 Compound CID: 53217091Formula: C13H25BO2 Molecular Weight: 224.15IUPAC Name: 2-cycloheptyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneSMILES: B1(OC(C(O1)(C)C)(C)C)C2CCCCCC2InChIKey: SXXIRRKFRJTGRV-UHFFFAOYSA-NInChI: InChI=1S/C13H25BO2/c1-12(2)13(3,4)16-14(15-12)11-9-7-5-6-8-10-11/h11H,5-10H2,1-4H3
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2-(Thiophen-2-yl)-1，3，2-dioxaborinaneCas Number: 197024-83-2 Compound CID: 46738977Formula: C7H9BO2S Molecular Weight: 168.03IUPAC Name: 2-thiophen-2-yl-1,3,2-dioxaborinaneSMILES: B1(OCCCO1)C2=CC=CS2InChIKey: CVRRKUUSGIROSB-UHFFFAOYSA-NInChI: InChI=1S/C7H9BO2S/c1-3-7(11-6-1)8-9-4-2-5-10-8/h1,3,6H,2,4-5H2
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2-(3，4-Dihydro-2H-pyran-5-yl)-4，4，5，5-tetramethyl-1，3，2-dioxaborolaneCas Number: 1046811-99-7 Compound CID: 53217152Formula: C11H19BO3 Molecular Weight: 210.08IUPAC Name: 2-(3,4-dihydro-2H-pyran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolaneSMILES: B1(OC(C(O1)(C)C)(C)C)C2=COCCC2InChIKey: UQPQMEFVQNERGS-UHFFFAOYSA-NInChI: InChI=1S/C11H19BO3/c1-10(2)11(3,4)15-12(14-10)9-6-5-7-13-8-9/h8H,5-7H2,1-4H3
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5-(4，4，5，5-Tetramethyl-1，3，2-dioxaborolan-2-yl)thiophene-3-carbonitrileCas Number: 916454-59-6 Compound CID: 53398053Formula: C11H14BNO2S Molecular Weight: 235.11IUPAC Name: 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene-3-carbonitrileSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CS2)C#NInChIKey: OXYRAUHWTSONAV-UHFFFAOYSA-NInChI: InChI=1S/C11H14BNO2S/c1-10(2)11(3,4)15-12(14-10)9-5-8(6-13)7-16-9/h5,7H,1-4H3
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4,4,5,5-Tetramethyl-2-(3,3,5,5-tetramethylcyclohex-1-en-1-yl)-1,3,2-dioxaborolaneCas Number: 859217-85-9 Compound CID: 23142059Formula: C16H29BO2 Molecular Weight: 264.22IUPAC Name: 4,4,5,5-tetramethyl-2-(3,3,5,5-tetramethylcyclohexen-1-yl)-1,3,2-dioxaborolaneSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(CC(C2)(C)C)(C)CInChIKey: XVMFBRCBEYKITB-UHFFFAOYSA-NInChI: InChI=1S/C16H29BO2/c1-13(2)9-12(10-14(3,4)11-13)17-18-15(5,6)16(7,8)19-17/h9H,10-11H2,1-8H3
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4，4，5，5-Tetramethyl-2-(4-methyl-1-cyclohexen-1-yl)-1，3，2-dioxaborolaneCas Number: 865869-26-7 Compound CID: 58924635Formula: C13H23BO2 Molecular Weight: 222.14IUPAC Name: 4,4,5,5-tetramethyl-2-(4-methylcyclohexen-1-yl)-1,3,2-dioxaborolaneSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CCC(CC2)CInChIKey: SVHPQFUXPUDKLE-UHFFFAOYSA-NInChI: InChI=1S/C13H23BO2/c1-10-6-8-11(9-7-10)14-15-12(2,3)13(4,5)16-14/h8,10H,6-7,9H2,1-5H3
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3-Methyl-1-propyl-5-(4，4，5，5-tetramethyl-1，3，2-dioxaborolan-2-yl)-1H-pyrazoleCas Number: 847818-80-8 Compound CID: 11368688Formula: C13H23BN2O2 Molecular Weight: 250.15IUPAC Name: 3-methyl-1-propyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazoleSMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=NN2CCC)CInChIKey: NPVZCPBYUYTYFR-UHFFFAOYSA-NInChI: InChI=1S/C13H23BN2O2/c1-7-8-16-11(9-10(2)15-16)14-17-12(3,4)13(5,6)18-14/h9H,7-8H2,1-6H3
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3-(4，4，5，5-Tetramethyl-1，3，2-dioxaborolan-2-yl)thiophene-2-carbonitrileCas Number: 942070-34-0 Compound CID: 15979305Formula: C11H14BNO2S Molecular Weight: 235.11IUPAC Name: 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophene-2-carbonitrileSMILES: B1(OC(C(O1)(C)C)(C)C)C2=C(SC=C2)C#NInChIKey: HUZWPBPPEDMPTR-UHFFFAOYSA-NInChI: InChI=1S/C11H14BNO2S/c1-10(2)11(3,4)15-12(14-10)8-5-6-16-9(8)7-13/h5-6H,1-4H3
