11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine

C216H204O24P8 — CID 158256800

IUPAC11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine
SMILESCc1ccc(C(C)C)c2c1Cc1c(C)ccc(C(C)C)c1OP(Oc1ccc3ccccc3c1-c1c(OP3Oc4c(C(C)C)ccc(C)c4Cc4c(C)ccc(C(C)C)c4O3)ccc3ccccc13)O2.Cc1ccc(C)c2c1Cc1c(C)ccc(C)c1OP(Oc1ccc3ccccc3c1-c1c(OP3Oc4c(C)ccc(C)c4Cc4c(C)ccc(C)c4O3)ccc3ccccc13)O2.Cc1ccc(C)c2c1Cc1c(C)ccc(C)c1OP(Oc1ccccc1-c1ccccc1OP1Oc3c(C)ccc(C)c3Cc3c(C)ccc(C)c3O1)O2.Cc1cccc2c1OP(Oc1ccc3ccccc3c1-c1c(OP3Oc4c(cccc4C(C)C)Cc4cccc(C(C)C)c4O3)ccc3ccccc13)Oc1c(C)cccc1C2
InChIInChI=1S/C62H64O6P2.2C54H48O6P2.C46H44O6P2/c1-35(2)45-27-21-39(9)51-33-52-40(10)22-28-46(36(3)4)60(52)66-69(65-59(45)51)63-55-31-25-43-17-13-15-19-49(43)57(55)58-50-20-16-14-18-44(50)26-32-56(58)64-70-67-61-47(37(5)6)29-23-41(11)53(61)34-54-42(12)24-30-48(38(7)8)62(54)68-70;1-31-17-21-35(5)51-43(31)29-44-32(2)18-22-36(6)52(44)58-61(57-51)55-47-27-25-39-13-9-11-15-41(39)49(47)50-42-16-12-10-14-40(42)26-28-48(50)56-62-59-53-37(7)23-19-33(3)45(53)30-46-34(4)20-24-38(8)54(46)60-62;1-33(2)43-25-13-21-41-32-42-22-14-26-44(34(3)4)54(42)60-62(59-53(41)43)56-48-30-28-38-18-8-10-24-46(38)50(48)49-45-23-9-7-17-37(45)27-29-47(49)55-61-57-51-35(5)15-11-19-39(51)31-40-20-12-16-36(6)52(40)58-61;1-27-17-21-31(5)43-37(27)25-38-28(2)18-22-32(6)44(38)50-53(49-43)47-41-15-11-9-13-35(41)36-14-10-12-16-42(36)48-54-51-45-33(7)23-19-29(3)39(45)26-40-30(4)20-24-34(8)46(40)52-54/h13-32,35-38H,33-34H2,1-12H3;9-28H,29-30H2,1-8H3;7-30,33-34H,31-32H2,1-6H3;9-24H,25-26H2,1-8H3
InChIKeyGHJPVCFSGYVFKJ-UHFFFAOYSA-N
MW3431.78 g/mol
LogP63.20
Rot. Bonds26

About 11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine

11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine (PubChem CID 158256800) has the molecular formula C216H204O24P8 and a molecular weight of 3431.78 g/mol. Its IUPAC name is 11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine.

Molecular Properties

Compound Name11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine
PubChem CID158256800
Molecular FormulaC216H204O24P8
Molecular Weight3431.78 g/mol
Exact Mass3429.26
IUPAC Name11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine
SMILESCc1ccc(C(C)C)c2c1Cc1c(C)ccc(C(C)C)c1OP(Oc1ccc3ccccc3c1-c1c(OP3Oc4c(C(C)C)ccc(C)c4Cc4c(C)ccc(C(C)C)c4O3)ccc3ccccc13)O2.Cc1ccc(C)c2c1Cc1c(C)ccc(C)c1OP(Oc1ccc3ccccc3c1-c1c(OP3Oc4c(C)ccc(C)c4Cc4c(C)ccc(C)c4O3)ccc3ccccc13)O2.Cc1ccc(C)c2c1Cc1c(C)ccc(C)c1OP(Oc1ccccc1-c1ccccc1OP1Oc3c(C)ccc(C)c3Cc3c(C)ccc(C)c3O1)O2.Cc1cccc2c1OP(Oc1ccc3ccccc3c1-c1c(OP3Oc4c(cccc4C(C)C)Cc4cccc(C(C)C)c4O3)ccc3ccccc13)Oc1c(C)cccc1C2
InChIInChI=1S/C62H64O6P2.2C54H48O6P2.C46H44O6P2/c1-35(2)45-27-21-39(9)51-33-52-40(10)22-28-46(36(3)4)60(52)66-69(65-59(45)51)63-55-31-25-43-17-13-15-19-49(43)57(55)58-50-20-16-14-18-44(50)26-32-56(58)64-70-67-61-47(37(5)6)29-23-41(11)53(61)34-54-42(12)24-30-48(38(7)8)62(54)68-70;1-31-17-21-35(5)51-43(31)29-44-32(2)18-22-36(6)52(44)58-61(57-51)55-47-27-25-39-13-9-11-15-41(39)49(47)50-42-16-12-10-14-40(42)26-28-48(50)56-62-59-53-37(7)23-19-33(3)45(53)30-46-34(4)20-24-38(8)54(46)60-62;1-33(2)43-25-13-21-41-32-42-22-14-26-44(34(3)4)54(42)60-62(59-53(41)43)56-48-30-28-38-18-8-10-24-46(38)50(48)49-45-23-9-7-17-37(45)27-29-47(49)55-61-57-51-35(5)15-11-19-39(51)31-40-20-12-16-36(6)52(40)58-61;1-27-17-21-31(5)43-37(27)25-38-28(2)18-22-32(6)44(38)50-53(49-43)47-41-15-11-9-13-35(41)36-14-10-12-16-42(36)48-54-51-45-33(7)23-19-29(3)39(45)26-40-30(4)20-24-34(8)46(40)52-54/h13-32,35-38H,33-34H2,1-12H3;9-28H,29-30H2,1-8H3;7-30,33-34H,31-32H2,1-6H3;9-24H,25-26H2,1-8H3
InChIKeyGHJPVCFSGYVFKJ-UHFFFAOYSA-N
XLogP63.20
TPSA221.52 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds26
Heavy Atoms248
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003431.78
LogP ≤ 563.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze 11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine with MolForge

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Launch Full Analysis

Related Compounds

11-phenyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine
CID 19706021
1,8-bis(benzo[d][1,3,2]benzodioxaphosphepin-6-yloxy)anthracene-9,10-dione;1,8-bis(12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yloxy)anthracene-9,10-dione;[8-bis[2-(1,3-dioxolan-2-yl)phenoxy]phosphanyloxy-9,10-dioxoanthracen-1-yl] bis[2-(1,3-dioxolan-2-yl)phenyl] phosphite;[5-bis(2-methylphenoxy)phosphanyloxy-9H-xanthen-4-yl] bis(2-methylphenyl) phosphite;[8-bis(2-propan-2-ylphenoxy)phosphanyloxy-9,10-dioxoanthracen-1-yl] (2-methylphenyl) (2-propan-2-ylphenyl) phosphite
CID 160693252
11-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)methyl]-1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocine
CID 23561224
2-(2-methoxynaphthalen-1-yl)-6-methyl-3-propan-2-ylphenol
CID 102189709
2-[1-[2-(4-oxobenzo[g][1,3,2]benzodioxaphosphinin-2-yl)oxynaphthalen-1-yl]naphthalen-2-yl]oxybenzo[g][1,3,2]benzodioxaphosphinin-4-one
CID 142213193
3-methyl-2-naphthalen-1-yl-1-(2-propan-2-ylphenyl)-4,5-dihydrobenzo[e]isoindole
CID 175551247
2-methyl-1-(2-methyl-1H-inden-4-yl)naphthalene
CID 172999052
7-methylpentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene
CID 160819244
7-methylpentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene
CID 158908888
2-methyl-1-(2-methylphenyl)naphthalene
CID 14204979
6-[2-[2-(2,4-dioxa-3-phosphatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaen-3-yloxy)-3,5-dimethylphenyl]-4,6-dimethylphenoxy]benzo[d][1,3,2]benzodioxaphosphepine;11-[2-[2-(2,4-dioxa-3-phosphatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaen-3-yloxy)-3,5-dimethylphenyl]-4,6-dimethylphenoxy]-1,3,7,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocine
CID 159415230
8,9-dimethyl-7H-benzo[c]fluorene
CID 159520619

Frequently Asked Questions

What is the IUPAC name of 11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine?
The IUPAC name of 11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine (CID 158256800) is 11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine.
What is the SMILES notation for 11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine?
The canonical SMILES for 11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine is Cc1ccc(C(C)C)c2c1Cc1c(C)ccc(C(C)C)c1OP(Oc1ccc3ccccc3c1-c1c(OP3Oc4c(C(C)C)ccc(C)c4Cc4c(C)ccc(C(C)C)c4O3)ccc3ccccc13)O2.Cc1ccc(C)c2c1Cc1c(C)ccc(C)c1OP(Oc1ccc3ccccc3c1-c1c(OP3Oc4c(C)ccc(C)c4Cc4c(C)ccc(C)c4O3)ccc3ccccc13)O2.Cc1ccc(C)c2c1Cc1c(C)ccc(C)c1OP(Oc1ccccc1-c1ccccc1OP1Oc3c(C)ccc(C)c3Cc3c(C)ccc(C)c3O1)O2.Cc1cccc2c1OP(Oc1ccc3ccccc3c1-c1c(OP3Oc4c(cccc4C(C)C)Cc4cccc(C(C)C)c4O3)ccc3ccccc13)Oc1c(C)cccc1C2.
What is the InChIKey of 11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine?
The InChIKey is GHJPVCFSGYVFKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H64O6P2.2C54H48O6P2.C46H44O6P2/c1-35(2)45-27-21-39(9)51-33-52-40(10)22-28-46(36(3)4)60(52)66-69(65-59(45)51)63-55-31-25-43-17-13-15-19-49(43)57(55)58-50-20-16-14-18-44(50)26-32-56(58)64-70-67-61-47(37(5)6)29-23-41(11)53(61)34-54-42(12)24-30-48(38(7)8)62(54)68-70;1-31-17-21-35(5)51-43(31)29-44-32(2)18-22-36(6)52(44)58-61(57-51)55-47-27-25-39-13-9-11-15-41(39)49(47)50-42-16-12-10-14-40(42)26-28-48(50)56-62-59-53-37(7)23-19-33(3)45(53)30-46-34(4)20-24-38(8)54(46)60-62;1-33(2)43-25-13-21-41-32-42-22-14-26-44(34(3)4)54(42)60-62(59-53(41)43)56-48-30-28-38-18-8-10-24-46(38)50(48)49-45-23-9-7-17-37(45)27-29-47(49)55-61-57-51-35(5)15-11-19-39(51)31-40-20-12-16-36(6)52(40)58-61;1-27-17-21-31(5)43-37(27)25-38-28(2)18-22-32(6)44(38)50-53(49-43)47-41-15-11-9-13-35(41)36-14-10-12-16-42(36)48-54-51-45-33(7)23-19-29(3)39(45)26-40-30(4)20-24-34(8)46(40)52-54/h13-32,35-38H,33-34H2,1-12H3;9-28H,29-30H2,1-8H3;7-30,33-34H,31-32H2,1-6H3;9-24H,25-26H2,1-8H3.
What are the key properties of 11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine?
11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine has a molecular weight of 3431.78 g/mol, XLogP of 63.20, 26 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[1-[2-[(1,9-dimethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;11-[1-[2-[[4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl]oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-4,6-dimethyl-1,9-di(propan-2-yl)-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[1-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]naphthalen-1-yl]naphthalen-2-yl]oxy-5H-benzo[d][1,3,2]benzodioxaphosphocine;1,4,6,9-tetramethyl-11-[2-[2-[(1,4,6,9-tetramethyl-5H-benzo[d][1,3,2]benzodioxaphosphocin-11-yl)oxy]phenyl]phenoxy]-5H-benzo[d][1,3,2]benzodioxaphosphocine is sourced from PubChem (CID 158256800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).