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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
Isotopically Labeled
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Found 9 results

Search term: C43H87N2O6P (Found by molecular formula)
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
23113477

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C43H87N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-43(47)44-41(40-51-52(48,49)50-39-38-45(3,4)5)42(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h34,36,41-42,46H,6-33,35,37-40H2,1-5H3,(H-,44,47,48,49)/b36-34+/t41-,42+/m0/s1
C43H87N2O6P759.1344202000
28533358

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C43H87N2O6P/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-27-30-33-36-43(47)44-41(39-51-52(48,49)50-38-37-45(4,5)6)42(46)35-32-29-26-23-21-22-25-28-31-34-40(2)3/h32,35,40-42,46H,7-31,33-34,36-39H2,1-6H3,(H-,44,47,48,49)/b35-32+/t41-,42+/m0/s1
C43H87N2O6P759.13443400
58168492

Double-bond stereo

2 of 3 defined stereocentres - 2/3 defined
InChI=1/C43H87N2O6P/c1-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27-30-33-36-43(47)44-41(39-51-52(48,49)50-38-37-45(4,5)6)42(46)35-32-29-26-24-23-25-28-31-34-40(3)8-2/h32,35,40-42,46H,7-31,33-34,36-39H2,1-6H3,(H-,44,47,48,49)/b35-32+/t40?,41-,42+/m0/s1
C43H87N2O6P759.13443400
113381528

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C43H87N2O6P/c1-6-8-10-12-14-16-18-19-20-21-22-23-24-25-27-29-31-33-35-37-43(47)44-41(40-51-52(48,49)50-39-38-45(3,4)5)42(46)36-34-32-30-28-26-17-15-13-11-9-7-2/h34,36,41-42,46H,6-33,35,37-40H2,1-5H3,(H-,44,47,48,49)/b36-34+/t41-,42+/m0/s1
C43H87N2O6P759.13442200
128913248

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C43H87N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-43(47)44-41(40-51-52(48,49)50-39-38-45(3,4)5)42(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h34,36,41-42,46H,6-33,35,37-40H2,1-5H3,(H-,44,47,48,49)
C43H87N2O6P759.13441100
24608389

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C43H87N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-43(47)44-41(40-51-52(48,49)50-39-38-45(3,4)5)42(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h34,36,41-42,46H,6-33,35,37-40H2,1-5H3,(H-,44,47,48,49)/b36-34+/t41-,42+/m1/s1
C43H87N2O6P759.134411600
71044193

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C43H87N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-43(47)44-41(40-51-52(48,49)50-39-38-45(3,4)5)42(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h34,36,41-42,46H,6-33,35,37-40H2,1-5H3,(H-,44,47,48,49)/b36-34+/t41?,42-/m1/s1
C43H87N2O6P759.13441800
75320549

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C43H87N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-43(47)44-41(40-51-52(48,49)50-39-38-45(3,4)5)42(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h17,19,41-42,46H,6-16,18,20-40H2,1-5H3,(H-,44,47,48,49)/b19-17+/t41-,42+/m0/s1
C43H87N2O6P759.13441100
9552626

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C43H87N2O6P/c1-7-9-11-13-15-17-19-21-22-23-25-27-29-31-33-35-37-43(46)44-41(40-51-52(47,48)50-39-38-45(3,4)5)42(49-6)36-34-32-30-28-26-24-20-18-16-14-12-10-8-2/h34,36,41-42H,7-33,35,37-40H2,1-6H3,(H-,44,46,47,48)/b36-34+
C43H87N2O6P759.13441100

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