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Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
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Found 77 results

Search term: C27H32O2 (Found by molecular formula)
1234
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
339153

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C27H32O2/c1-15(28)25-21-7-3-5-17(21)9-19-11-27(13-23(19)25)12-20-10-18-6-4-8-22(18)26(16(2)29)24(20)14-27/h9-10,15-16,28-29H,3-8,11-14H2,1-2H3
C27H32O2388.54187500
9398027
InChI=1/C27H32O2/c28-22-14-3-1-2-4-15-23-29-27(24-16-8-5-9-17-24,25-18-10-6-11-19-25)26-20-12-7-13-21-26/h5-13,16-21,28H,1-4,14-15,22-23H2
C27H32O2388.54186400
2029588

1 of 6 defined stereocentres - 1/6 defined
InChI=1/C27H32O2/c1-25-14-11-21(28)18-20(25)8-9-22-23(25)12-15-26(2)24(22)13-17-27(26,29)16-10-19-6-4-3-5-7-19/h3-7,18,22-24,29H,8-9,11-15,17H2,1-2H3/t22?,23?,24?,25?,26?,27-/m0/s1
C27H32O2388.541785400
2327359
InChI=1/C27H32O2/c1-26(2,3)22-14-16-23(17-15-22)27(4,5)20-28-19-21-10-9-13-25(18-21)29-24-11-7-6-8-12-24/h6-18H,19-20H2,1-5H3
C27H32O2388.541785600
8985628

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H32O2/c1-26-14-12-20(28)17-24(26)19(9-8-18-6-4-3-5-7-18)16-21-22-10-11-25(29)27(22,2)15-13-23(21)26/h3-7,16-17,21-23H,8-15H2,1-2H3/t21-,22-,23-,26+,27-/m0/s1
C27H32O2388.54185400
9814403

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C27H32O2/c1-27-15-14-21-22(24(27)8-5-9-26(27)29)13-12-19-17-25(28)20(16-23(19)21)11-10-18-6-3-2-4-7-18/h2-4,6-7,16-17,21-22,24,28H,5,8-15H2,1H3/t21-,22+,24-,27-/m0/s1
C27H32O2388.54185400
9265534

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H32O2/c1-18-3-5-19(6-4-18)11-15-27(29)16-13-25-24-9-7-20-17-21(28)8-10-22(20)23(24)12-14-26(25,27)2/h3-6,8,10-11,15,17,23-25,28-29H,7,9,12-14,16H2,1-2H3/b15-11+/t23-,24-,25+,26+,27+/m1/s1
C27H32O2388.54184300
151114
InChI=1/C15H16O2.C8H8.C4H8/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;1-2-8-6-4-3-5-7-8;1-4(2)3/h3-10,16-17H,1-2H3;2-7H,1H2;1H2,2-3H3
C27H32O2388.541784500
9421271

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H32O2/c1-18-3-5-19(6-4-18)11-15-27(29)16-13-25-24-9-7-20-17-21(28)8-10-22(20)23(24)12-14-26(25,27)2/h3-6,8,10-11,15,17,23-25,28-29H,7,9,12-14,16H2,1-2H3/b15-11-/t23-,24-,25+,26+,27+/m1/s1
C27H32O2388.54184300
2989298

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C27H32O2/c1-19(2)21-11-13-23-22(17-21)12-14-24-26(3,15-8-16-27(23,24)4)18-29-25(28)20-9-6-5-7-10-20/h5-7,9-14,17,19,24H,8,15-16,18H2,1-4H3
C27H32O2388.541783200
3479471

0 of 6 defined stereocentres - 0/6 defined
InChI=1/C27H32O2/c1-25-14-11-21(28)18-20(25)8-9-22-23(25)12-15-26(2)24(22)13-17-27(26,29)16-10-19-6-4-3-5-7-19/h3-7,18,22-24,29H,8-9,11-15,17H2,1-2H3
C27H32O2388.541783200
9756626
InChI=1/C27H32O2/c28-18-7-5-3-1-2-4-6-8-19-29-20-24-15-14-23-13-12-21-10-9-11-22-16-17-25(24)27(23)26(21)22/h9-17,28H,1-8,18-20H2
C27H32O2388.54183200
35765102
InChI=1/C27H32O2/c1-26(2,3)21-16-10-14-19(24(21)28)23(18-12-8-7-9-13-18)20-15-11-17-22(25(20)29)27(4,5)6/h7-17,23,28-29H,1-6H3
C27H32O2388.54183300
35801458

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H32O2/c28-27(29-24-16-10-2-1-3-11-17-24)23-18-19-25(21-12-6-4-7-13-21)26(20-23)22-14-8-5-9-15-22/h4-9,12-15,23-24H,1-3,10-11,16-20H2
C27H32O2388.54183400
57518133

Double-bond stereo
InChI=1/C27H32O2/c1-29-27(28)16-10-8-6-4-2-3-5-7-9-13-22-17-18-25-20-23-14-11-12-15-24(23)21-26(25)19-22/h9,11-15,17-21H,2-8,10,16H2,1H3/b13-9+
C27H32O2388.54183300
58910827

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H32O2/c1-27-15-14-22-21-11-10-20(28)17-23(21)19(9-5-8-18-6-3-2-4-7-18)16-24(22)25(27)12-13-26(27)29/h2-4,6-7,10-11,17,19,22,24-25,28H,5,8-9,12-16H2,1H3/t19-,22+,24+,25-,27-/m0/s1
C27H32O2388.54183300
58916864

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C27H32O2/c1-27-15-14-22-21-11-10-20(28)17-23(21)19(9-5-8-18-6-3-2-4-7-18)16-24(22)25(27)12-13-26(27)29/h2-4,6-7,10-11,17,19,22,24-25,28H,5,8-9,12-16H2,1H3/t19-,22-,24-,25+,27+/m1/s1
C27H32O2388.54183300
9570028

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C27H32O2/c1-27(2,21-13-17-25(18-14-21)28-23-9-5-3-6-10-23)22-15-19-26(20-16-22)29-24-11-7-4-8-12-24/h5,7,9,11,13-20,23-24H,3-4,6,8,10,12H2,1-2H3
C27H32O2388.54182100
9684123

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C27H32O2/c1-2-27-15-14-21-22(24(27)12-13-26(27)29)11-10-19-17-25(28)20(16-23(19)21)9-8-18-6-4-3-5-7-18/h3-7,16-17,21-22,24,28H,2,8-15H2,1H3/t21-,22+,24-,27-/m0/s1
C27H32O2388.54182100
9985832

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C27H32O2/c1-3-27-16-15-23-22-12-10-21(28-2)17-20(22)9-11-24(23)25(27)13-14-26(27)29-18-19-7-5-4-6-8-19/h4-8,10,12,15,17,24-26H,3,9,11,13-14,16,18H2,1-2H3/t24-,25+,26+,27+/m1/s1
C27H32O2388.54182100
1234

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