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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 29 results

Search term: C42H80NO10P (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
7826037

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h18,20,38-39H,3-17,19,21-37,43H2,1-2H3,(H,46,47)(H,48,49)/b20-18-/t38-,39+/m1/s1
C42H80NO10P790.0591151600
7826044

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17,19,38-39H,3-16,18,20-37,43H2,1-2H3,(H,46,47)(H,48,49)/b19-17-/t38-,39+/m1/s1
C42H80NO10P790.0591121500
74875725

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-24-26-28-30-32-34-41(45)53-38(36-51-54(48,49)52-37-39(43)42(46)47)35-50-40(44)33-31-29-27-25-23-14-12-10-8-6-4-2/h10,12,38-39H,3-9,11,13-37,43H2,1-2H3,(H,46,47)(H,48,49)/b12-10-/t38-,39+/m1/s1
C42H80NO10P790.05914400
74875732

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-41(45)53-38(36-51-54(48,49)52-37-39(43)42(46)47)35-50-40(44)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h17-18,38-39H,3-16,19-37,43H2,1-2H3,(H,46,47)(H,48,49)/b18-17-/t38-,39+/m1/s1
C42H80NO10P790.05914400
74875733

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-41(45)53-38(36-51-54(48,49)52-37-39(43)42(46)47)35-50-40(44)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h14,16,38-39H,3-13,15,17-37,43H2,1-2H3,(H,46,47)(H,48,49)/b16-14-/t38-,39+/m1/s1
C42H80NO10P790.05914400
74875958

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-22-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-21-16-14-12-10-8-6-4-2/h14,16,38-39H,3-13,15,17-37,43H2,1-2H3,(H,46,47)(H,48,49)/b16-14-/t38-,39+/m1/s1
C42H80NO10P790.05914400
74875986

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-22-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-21-16-14-12-10-8-6-4-2/h17-18,38-39H,3-16,19-37,43H2,1-2H3,(H,46,47)(H,48,49)/b18-17-/t38-,39+/m1/s1
C42H80NO10P790.05914400
74876151

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-24-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-23-14-12-10-8-6-4-2/h10,12,38-39H,3-9,11,13-37,43H2,1-2H3,(H,46,47)(H,48,49)/b12-10-/t38-,39+/m1/s1
C42H80NO10P790.05914400
97091894

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-6-8-10-11-12-13-14-15-16-19-22-25-29-33-41(44)49-37-40(38-51-54(47,48)50-36-35-43(3,4)5)52-42(45)34-30-26-23-20-17-18-21-24-28-32-39(53-46)31-27-9-7-2/h21,24,28,32,39-40H,6-20,22-23,25-27,29-31,33-38H2,1-5H3,(H-,46,47,48)/b24-21-,32-28+/t39-,40+/m0/s1
C42H80NO10P790.05914400
74876179

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-24-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-23-14-12-10-8-6-4-2/h16-17,38-39H,3-15,18-37,43H2,1-2H3,(H,46,47)(H,48,49)/b17-16-/t38-,39+/m1/s1
C42H80NO10P790.05913300
74875735

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h14,16,38-39H,3-13,15,17-37,43H2,1-2H3,(H,46,47)(H,48,49)/b16-14-/t38-,39+/m1/s1
C42H80NO10P790.05913300
74875747

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-24-26-28-30-32-34-41(45)53-38(36-51-54(48,49)52-37-39(43)42(46)47)35-50-40(44)33-31-29-27-25-23-14-12-10-8-6-4-2/h16-17,38-39H,3-15,18-37,43H2,1-2H3,(H,46,47)(H,48,49)/b17-16-/t38-,39+/m1/s1
C42H80NO10P790.05913300
74875831

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h13,15,38-39H,3-12,14,16-37,43H2,1-2H3,(H,46,47)(H,48,49)/b15-13-/t38-,39+/m1/s1
C42H80NO10P790.05913300
8138008

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h18,20,38-39H,3-17,19,21-37,43H2,1-2H3,(H,46,47)(H,48,49)/b20-18-
C42H80NO10P790.05913400
7826026

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h18,20,38-39H,3-17,19,21-37,43H2,1-2H3,(H,46,47)(H,48,49)/b20-18-/t38?,39-/m0/s1
C42H80NO10P790.05913300
7826032

Double-bond stereo

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17,19,38-39H,3-16,18,20-37,43H2,1-2H3,(H,46,47)(H,48,49)/b19-17-/t38?,39-/m0/s1
C42H80NO10P790.05913300
113376325

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h16,18,38-39H,3-15,17,19-37,43H2,1-2H3,(H,46,47)(H,48,49)/b18-16-/t38-,39+/m1/s1
C42H80NO10P790.05911100
113376353

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-21-18-16-14-12-10-8-6-4-2/h19-20,38-39H,3-18,21-37,43H2,1-2H3,(H,46,47)(H,48,49)/b20-19-/t38-,39+/m1/s1
C42H80NO10P790.05911100
113376435

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-23-16-14-12-10-8-6-4-2/h12,14,38-39H,3-11,13,15-37,43H2,1-2H3,(H,46,47)(H,48,49)/b14-12-/t38-,39+/m1/s1
C42H80NO10P790.05911100
113376468

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C42H80NO10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-24-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-23-14-12-10-8-6-4-2/h18-19,38-39H,3-17,20-37,43H2,1-2H3,(H,46,47)(H,48,49)/b19-18-/t38-,39+/m1/s1
C42H80NO10P790.05911100
12

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