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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 32 results

Search term: C50H98NO8P (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24766723

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51(3,4)5)46-56-49(52)42-40-38-36-34-32-30-28-21-19-17-15-13-11-9-7-2/h20,22,48H,6-19,21,23-47H2,1-5H3/b22-20-/t48-/m1/s1
C50H98NO8P872.2888131400
24766786

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51(3,4)5)46-56-49(52)42-40-38-36-34-32-30-28-21-19-17-15-13-11-9-7-2/h21,28,48H,6-20,22-27,29-47H2,1-5H3/b28-21-/t48-/m1/s1
C50H98NO8P872.2888121300
24766944

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51(3,4)5)46-56-49(52)42-40-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h20,22,48H,6-19,21,23-47H2,1-5H3/b22-20-/t48-/m1/s1
C50H98NO8P872.2888121300
24767422

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-28-21-19-17-15-13-11-9-7-2/h21,28,48H,6-20,22-27,29-47H2,1-5H3/b28-21-/t48-/m1/s1
C50H98NO8P872.2888121300
24767199

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-29-26-23-21-19-17-15-13-11-9-7-2/h21,23,48H,6-20,22,24-47H2,1-5H3/b23-21-/t48-/m1/s1
C50H98NO8P872.2888121300
24767230

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-29-26-23-21-19-17-15-13-11-9-7-2/h20,22,48H,6-19,21,23-47H2,1-5H3/b22-20-/t48-/m1/s1
C50H98NO8P872.2888111100
24767421

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-28-21-19-17-15-13-11-9-7-2/h17,19,48H,6-16,18,20-47H2,1-5H3/b19-17-/t48-/m1/s1
C50H98NO8P872.2888111100
24767452

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-28-21-19-17-15-13-11-9-7-2/h20,22,48H,6-19,21,23-47H2,1-5H3/b22-20-/t48-/m1/s1
C50H98NO8P872.2888111100
24766976

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51(3,4)5)46-56-49(52)42-40-38-36-34-32-30-28-26-23-21-19-17-15-13-11-9-7-2/h21,23,48H,6-20,22,24-47H2,1-5H3/b23-21-/t48-/m1/s1
C50H98NO8P872.2888111100
24766755

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51(3,4)5)46-56-49(52)42-40-38-36-34-32-30-28-21-19-17-15-13-11-9-7-2/h17,19,48H,6-16,18,20-47H2,1-5H3/b19-17-/t48-/m1/s1
C50H98NO8P872.2888111100
74850178

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H98NO8P/c1-4-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51-3)46-56-49(52)42-40-38-36-34-32-30-28-26-21-19-17-15-13-11-9-7-5-2/h18,20,48,51H,4-17,19,21-47H2,1-3H3,(H,54,55)/b20-18-
C50H98NO8P872.28883300
74850206

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H98NO8P/c1-4-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51-3)46-56-49(52)42-40-38-36-34-32-30-28-26-21-19-17-15-13-11-9-7-5-2/h19,21,48,51H,4-18,20,22-47H2,1-3H3,(H,54,55)/b21-19-
C50H98NO8P872.28883300
74850400

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H98NO8P/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51-3)59-50(53)43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h19,21,48,51H,4-18,20,22-47H2,1-3H3,(H,54,55)/b21-19-
C50H98NO8P872.28883300
74850426

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H98NO8P/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51-3)59-50(53)43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h18,20,48,51H,4-17,19,21-47H2,1-3H3,(H,54,55)/b20-18-
C50H98NO8P872.28883300
74850585

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H98NO8P/c1-4-6-8-10-12-14-16-18-20-22-23-24-25-27-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51-3)59-50(53)43-41-39-37-35-33-31-29-26-21-19-17-15-13-11-9-7-5-2/h19,21,48,51H,4-18,20,22-47H2,1-3H3,(H,54,55)/b21-19-
C50H98NO8P872.28883300
74850611

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H98NO8P/c1-4-6-8-10-12-14-16-18-20-22-23-24-25-27-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51-3)59-50(53)43-41-39-37-35-33-31-29-26-21-19-17-15-13-11-9-7-5-2/h18,20,48,51H,4-17,19,21-47H2,1-3H3,(H,54,55)/b20-18-
C50H98NO8P872.28883300
59695220

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-29-26-23-21-19-17-15-13-11-9-7-2/h20,22,48H,6-19,21,23-47H2,1-5H3/b22-20+/t48-/m1/s1
C50H98NO8P872.28882200
59695252

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-28-21-19-17-15-13-11-9-7-2/h17,19,48H,6-16,18,20-47H2,1-5H3/b19-17+/t48-/m1/s1
C50H98NO8P872.28882200
59695253

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-28-21-19-17-15-13-11-9-7-2/h21,28,48H,6-20,22-27,29-47H2,1-5H3/b28-21+/t48-/m1/s1
C50H98NO8P872.28882200
59695259

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H98NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-26-27-29-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-28-21-19-17-15-13-11-9-7-2/h20,22,48H,6-19,21,23-47H2,1-5H3/b22-20+/t48-/m1/s1
C50H98NO8P872.28882200
12

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