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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 76 results

Search term: C21H20Cl2O3 (Found by molecular formula)
1234
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
36845


0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H20Cl2O3/c1-21(2)17(12-18(22)23)19(21)20(24)25-13-14-7-6-10-16(11-14)26-15-8-4-3-5-9-15/h3-12,17,19H,13H2,1-2H3
C21H20Cl2O3391.2877111123944846711
39931

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H20Cl2O3/c1-21(2)17(12-18(22)23)19(21)20(24)25-13-14-7-6-10-16(11-14)26-15-8-4-3-5-9-15/h3-12,17,19H,13H2,1-2H3/t17-,19+/m1/s1
C21H20Cl2O3391.28774475567
36968

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H20Cl2O3/c1-21(2)17(12-18(22)23)19(21)20(24)25-13-14-7-6-10-16(11-14)26-15-8-4-3-5-9-15/h3-12,17,19H,13H2,1-2H3/t17-,19-/m0/s1
C21H20Cl2O3391.28773982546
36702

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H20Cl2O3/c1-21(2)17(12-18(22)23)19(21)20(24)25-13-14-7-6-10-16(11-14)26-15-8-4-3-5-9-15/h3-12,17,19H,13H2,1-2H3/t17-,19+/m0/s1
C21H20Cl2O3391.28773342566
55923

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H20Cl2O3/c1-21(2)17(12-18(22)23)19(21)20(24)25-13-14-7-6-10-16(11-14)26-15-8-4-3-5-9-15/h3-12,17,19H,13H2,1-2H3/t17-,19-/m1/s1
C21H20Cl2O3391.28771616546
1800637
InChI=1/C21H20Cl2O3/c22-18-10-17(11-19(23)12-18)21(25)26-13-20(24)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h6-12,14H,1-5,13H2
C21H20Cl2O3391.287712700
23936987

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C21H20Cl2O3/c1-21(2)17(12-18(22)23)19(21)20(24)25-13-14-7-6-10-16(11-14)26-15-8-4-3-5-9-15/h3-12,17,19H,13H2,1-2H3/t17-,19?/m0/s1
C21H20Cl2O3391.28775500
30846592

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H20Cl2O3/c22-16-10-15(7-6-14-4-2-1-3-5-14)19(20(23)11-16)9-8-18-12-17(24)13-21(25)26-18/h1-5,8-11,17-18,24H,6-7,12-13H2/b9-8+/t17-,18-/m1/s1
C21H20Cl2O3391.28774400
52564081

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H20Cl2O3/c1-20(2)17(13-18(22)23)21(20,19(24)25-3)14-8-7-11-16(12-14)26-15-9-5-4-6-10-15/h4-13,17H,1-3H3/t17-,21-/m1/s1
C21H20Cl2O3391.28774500
30846595

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H20Cl2O3/c1-12-3-4-13(2)21(14-5-8-18(22)19(23)9-14)17(12)7-6-16-10-15(24)11-20(25)26-16/h3-9,15-16,24H,10-11H2,1-2H3/b7-6+/t15-,16-/m1/s1
C21H20Cl2O3391.28773300
30808982

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H20Cl2O3/c1-12-5-13(2)7-14(6-12)19-8-15(22)9-20(23)18(19)4-3-17-10-16(24)11-21(25)26-17/h3-9,16-17,24H,10-11H2,1-2H3/b4-3+/t16-,17-/m1/s1
C21H20Cl2O3391.28773300
30809225

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H20Cl2O3/c1-12-7-13(2)17(5-4-16-10-15(24)11-21(25)26-16)18(8-12)14-3-6-19(22)20(23)9-14/h3-9,15-16,24H,10-11H2,1-2H3/b5-4+/t15-,16-/m1/s1
C21H20Cl2O3391.28773300
30846591

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C21H20Cl2O3/c1-2-13-4-3-5-14(8-13)19-9-15(22)10-20(23)18(19)7-6-17-11-16(24)12-21(25)26-17/h3-10,16-17,24H,2,11-12H2,1H3/b7-6+/t16-,17-/m1/s1
C21H20Cl2O3391.28773300
19961261

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C21H20Cl2O3/c1-21(2)17(12-18(22)23)19(21)20(24)25-13-14-7-6-10-16(11-14)26-15-8-4-3-5-9-15/h3-12,17,19H,13H2,1-2H3/t17?,19-/m0/s1
C21H20Cl2O3391.28773300
3337923

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H20Cl2O3/c1-21(2)17(12-18(22)23)19(21)20(24)25-13-14-8-10-16(11-9-14)26-15-6-4-3-5-7-15/h3-12,17,19H,13H2,1-2H3
C21H20Cl2O3391.28773200
6181713

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H20Cl2O3/c1-3-14(2)15-4-6-17(7-5-15)20(24)13-26-21(25)11-9-16-8-10-18(22)12-19(16)23/h4-12,14H,3,13H2,1-2H3/b11-9+/t14-/m1/s1
C21H20Cl2O3391.28772100
6181714

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C21H20Cl2O3/c1-3-14(2)15-4-6-17(7-5-15)20(24)13-26-21(25)11-9-16-8-10-18(22)12-19(16)23/h4-12,14H,3,13H2,1-2H3/b11-9+/t14-/m0/s1
C21H20Cl2O3391.28772100
6181718

Double-bond stereo
InChI=1/C21H20Cl2O3/c1-3-14-5-6-15(4-2)18(11-14)20(24)13-26-21(25)10-8-16-7-9-17(22)12-19(16)23/h5-12H,3-4,13H2,1-2H3/b10-8+
C21H20Cl2O3391.28772100
8310542

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C21H20Cl2O3/c1-19(2)20(3,21(19,18(24)25)13-17(22)23)14-8-7-11-16(12-14)26-15-9-5-4-6-10-15/h4-13H,1-3H3,(H,24,25)
C21H20Cl2O3391.28772100
8699876

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C21H20Cl2O3/c1-18(2)24-17-16-19(21(16,22)23,14-9-5-3-6-10-14)13-20(17,26-25-18)15-11-7-4-8-12-15/h3-12,16-17H,13H2,1-2H3/t16-,17-,19-,20-/m1/s1
C21H20Cl2O3391.28772100
1234

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