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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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Single/Multi-component
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Found 36 results

Search term: C50H96NO8P (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
24766756

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/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/h17,19-20,22,48H,6-16,18,21,23-47H2,1-5H3/b19-17-,22-20-/t48-/m1/s1
C50H96NO8P870.2729121200
24766787

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/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/h20-22,28,48H,6-19,23-27,29-47H2,1-5H3/b22-20-,28-21-/t48-/m1/s1
C50H96NO8P870.2729121200
24766819

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/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/h15,17,21,28,48H,6-14,16,18-20,22-27,29-47H2,1-5H3/b17-15-,28-21-/t48-/m1/s1
C50H96NO8P870.2729121200
24766945

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/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/h14,16,20,22,48H,6-13,15,17-19,21,23-47H2,1-5H3/b16-14-,22-20-/t48-/m1/s1
C50H96NO8P870.2729121200
24766977

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/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/h20-23,48H,6-19,24-47H2,1-5H3/b22-20-,23-21-/t48-/m1/s1
C50H96NO8P870.2729121200
24767009

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/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/h15,17,21,23,48H,6-14,16,18-20,22,24-47H2,1-5H3/b17-15-,23-21-/t48-/m1/s1
C50H96NO8P870.2729121200
24767200

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/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/h15,17,21,23,48H,6-14,16,18-20,22,24-47H2,1-5H3/b17-15-,23-21-/t48-/m1/s1
C50H96NO8P870.2729121200
24767231

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/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/h20-23,48H,6-19,24-47H2,1-5H3/b22-20-,23-21-/t48-/m1/s1
C50H96NO8P870.2729121200
24767263

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/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/h14,16,20,22,48H,6-13,15,17-19,21,23-47H2,1-5H3/b16-14-,22-20-/t48-/m1/s1
C50H96NO8P870.2729121200
24767423

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/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/h15,17,21,28,48H,6-14,16,18-20,22-27,29-47H2,1-5H3/b17-15-,28-21-/t48-/m1/s1
C50H96NO8P870.2729121200
24767453

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/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/h17,19-20,22,48H,6-16,18,21,23-47H2,1-5H3/b19-17-,22-20-/t48-/m1/s1
C50H96NO8P870.2729121200
24767454

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/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/h20-22,28,48H,6-19,23-27,29-47H2,1-5H3/b22-20-,28-21-/t48-/m1/s1
C50H96NO8P870.2729121200
24822391

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C50H96NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-28-29-31-33-35-37-39-41-43-50(53)59-48(47-58-60(54,55)57-45-44-51(3,4)5)46-56-49(52)42-40-38-36-34-32-30-19-17-15-13-11-9-7-2/h28-29,35,37,48H,6-27,30-34,36,38-47H2,1-5H3/b29-28-,37-35-/t48-/m1/s1
C50H96NO8P870.27295600
74850207

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H96NO8P/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/h18-21,48,51H,4-17,22-47H2,1-3H3,(H,54,55)/b20-18-,21-19-
C50H96NO8P870.27293300
74850235

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H96NO8P/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/h13,15,19,21,48,51H,4-12,14,16-18,20,22-47H2,1-3H3,(H,54,55)/b15-13-,21-19-
C50H96NO8P870.27293300
74850401

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H96NO8P/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/h13,15,19,21,48,51H,4-12,14,16-18,20,22-47H2,1-3H3,(H,54,55)/b15-13-,21-19-
C50H96NO8P870.27293300
74850427

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H96NO8P/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/h18-21,48,51H,4-17,22-47H2,1-3H3,(H,54,55)/b20-18-,21-19-
C50H96NO8P870.27293300
74850454

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H96NO8P/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/h12,14,18,20,48,51H,4-11,13,15-17,19,21-47H2,1-3H3,(H,54,55)/b14-12-,20-18-
C50H96NO8P870.27293300
74850586

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H96NO8P/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/h13,15,19,21,48,51H,4-12,14,16-18,20,22-47H2,1-3H3,(H,54,55)/b15-13-,21-19-
C50H96NO8P870.27293300
74850612

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C50H96NO8P/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/h18-21,48,51H,4-17,22-47H2,1-3H3,(H,54,55)/b20-18-,21-19-
C50H96NO8P870.27293300
12

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