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Oxanes
Description:
Compounds containing an oxane (tetrahydropyran) ring, which is a six-member saturated aliphatic heterocycle with one oxygen atom and five carbon atoms.
Ancestors:
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2-(Tetrahydro-2H-pyran-2-yl)ethan-1-amineCas Number: 40500-01-4 Compound CID: 17750935Formula: C7H16ClNO Molecular Weight: 165.66IUPAC Name: 2-(oxan-2-yl)ethanamineSMILES: C1CCOC(C1)CCNInChIKey: XHMSRGDEBWJLBE-UHFFFAOYSA-NInChI: InChI=1S/C7H15NO/c8-5-4-7-3-1-2-6-9-7/h7H,1-6,8H2 -
Methyl 4-cyanotetrahydro-2H-pyran-4-carboxylateCas Number: 362703-30-8 Compound CID: 16726727Formula: C8H11NO3 Molecular Weight: 169.18IUPAC Name: methyl 4-cyanooxane-4-carboxylateSMILES: COC(=O)C1(CCOCC1)C#NInChIKey: ZOCVBMSJKWEGQO-UHFFFAOYSA-NInChI: InChI=1S/C8H11NO3/c1-11-7(10)8(6-9)2-4-12-5-3-8/h2-5H2,1H3
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Methyl 2-(dihydro-2H-pyran-4(3H)-ylidene)acetateCas Number: 138302-49-5 Compound CID: 54595149IUPAC Name: methyl 2-(oxan-4-ylidene)acetateSMILES: COC(=O)C=C1CCOCC1InChIKey: HSLUJWIFSPCQBB-UHFFFAOYSA-NInChI: InChI=1S/C8H12O3/c1-10-8(9)6-7-2-4-11-5-3-7/h6H,2-5H2,1H3
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Ethyl 3-oxa-bicyclo[3.1.0]hexane-6-carboxylateCas Number: 335599-07-0Formula: C8H12O3 Molecular Weight: 156.18IUPAC Name: ethyl 3-oxabicyclo[3.1.0]hexane-6-carboxylateSMILES: CCOC(=O)C1C2C1COC2InChIKey: XAESUVRCRNJFDR-UHFFFAOYSA-NInChI: InChI=1S/C8H12O3/c1-2-11-8(9)7-5-3-10-4-6(5)7/h5-7H,2-4H2,1H3
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Ethyl 2-((tetrahydro-2H-pyran-2-yl)oxy)acetateCas Number: 61675-94-3 Compound CID: 10899396Formula: C9H16O4 Molecular Weight: 188.22IUPAC Name: ethyl 2-(oxan-2-yloxy)acetateSMILES: CCOC(=O)COC1CCCCO1InChIKey: GZVWKAGBBACFPD-UHFFFAOYSA-NInChI: InChI=1S/C9H16O4/c1-2-11-8(10)7-13-9-5-3-4-6-12-9/h9H,2-7H2,1H3
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5-Iodo-1-(tetrahydro-2H-pyran-2-yl)-1H-pyrazoleCas Number: 1311197-82-6 Compound CID: 54759103Formula: C8H11IN2O Molecular Weight: 278.09IUPAC Name: 5-iodo-1-(oxan-2-yl)pyrazoleSMILES: C1CCOC(C1)N2C(=CC=N2)IInChIKey: FMLVAXQYSRRRBO-UHFFFAOYSA-NInChI: InChI=1S/C8H11IN2O/c9-7-4-5-10-11(7)8-3-1-2-6-12-8/h4-5,8H,1-3,6H2
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5-(Tetrahydro-2H-pyran-4-yl)-1H-pyrazol-3-amineCas Number: 1000896-69-4 Compound CID: 54595847Formula: C8H13N3O Molecular Weight: 167.21IUPAC Name: 5-(oxan-4-yl)-1H-pyrazol-3-amineSMILES: C1COCCC1C2=CC(=NN2)NInChIKey: AQPGNHFZFXIMJB-UHFFFAOYSA-NInChI: InChI=1S/C8H13N3O/c9-8-5-7(10-11-8)6-1-3-12-4-2-6/h5-6H,1-4H2,(H3,9,10,11)
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4-Aminotetrahydro-2H-pyran-4-carbonitrileCas Number: 50289-12-8 Compound CID: 22063291Formula: C6H10N2O Molecular Weight: 126.16IUPAC Name: 4-aminooxane-4-carbonitrileSMILES: C1COCCC1(C#N)NInChIKey: RNLRIDPDRLEOSF-UHFFFAOYSA-NInChI: InChI=1S/C6H10N2O/c7-5-6(8)1-3-9-4-2-6/h1-4,8H2
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4-Aminotetrahydro-2H-Pyran AcetateCas Number: 1005498-91-8 Compound CID: 44118770Formula: C7H15NO3 Molecular Weight: 161.2IUPAC Name: acetic acid;oxan-4-amineSMILES: CC(=O)O.C1COCCC1NInChIKey: PFDSOUIEDDDQES-UHFFFAOYSA-NInChI: InChI=1S/C5H11NO.C2H4O2/c6-5-1-3-7-4-2-5;1-2(3)4/h5H,1-4,6H2;1H3,(H,3,4)
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(1-(Tetrahydro-2H-pyran-2-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)boronic acidCas Number: 1141878-45-6 Compound CID: 53216481Formula: C9H12BF3N2O3 Molecular Weight: 264.01IUPAC Name: [2-(oxan-2-yl)-5-(trifluoromethyl)pyrazol-3-yl]boronic acidSMILES: B(C1=CC(=NN1C2CCCCO2)C(F)(F)F)(O)OInChIKey: IIRVABFYRULQMI-UHFFFAOYSA-NInChI: InChI=1S/C9H12BF3N2O3/c11-9(12,13)6-5-7(10(16)17)15(14-6)8-3-1-2-4-18-8/h5,8,16-17H,1-4H2
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(1-(Tetrahydro-2H-pyran-2-yl)-1H-pyrazol-5-yl)boronic acidCas Number: 1105511-68-9 Compound CID: 46739463Formula: C8H13BN2O3 Molecular Weight: 196.02IUPAC Name: [2-(oxan-2-yl)pyrazol-3-yl]boronic acidSMILES: B(C1=CC=NN1C2CCCCO2)(O)OInChIKey: YRADCPLKXBTOTI-UHFFFAOYSA-NInChI: InChI=1S/C8H13BN2O3/c12-9(13)7-4-5-10-11(7)8-3-1-2-6-14-8/h4-5,8,12-13H,1-3,6H2
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(1-(Tetrahydro-2H-pyran-2-yl)-1H-pyrazol-4-yl)boronicacidCas Number: 1256345-68-2 Compound CID: 53216299Formula: C8H13BN2O3 Molecular Weight: 196.02IUPAC Name: [1-(oxan-2-yl)pyrazol-4-yl]boronic acidSMILES: B(C1=CN(N=C1)C2CCCCO2)(O)OInChIKey: BRMZVBYTGLUGDS-UHFFFAOYSA-NInChI: InChI=1S/C8H13BN2O3/c12-9(13)7-5-10-11(6-7)8-3-1-2-4-14-8/h5-6,8,12-13H,1-4H2
