benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane)

C303H364O35 — CID 158861458

IUPACbenzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane)
SMILESCC.CC.CC.CC.CC.CC.CC.CC.COCC(O)COC.COCC1CO1.COCC1CO1.Cc1cc(C(C)(C)c2ccc(C(C)(C)c3cc(C)c(OCC4CO4)c(C)c3)cc2)cc(C)c1OCC(O)COc1c(C)cc(C(C)(C)c2ccc(C(C)(C)c3cc(C)c(OCC4CO4)c(C)c3)cc2)cc1C.Cc1cc(C(c2ccccc2)(c2ccccc2)c2cc(C)c(OCC3CO3)c(C)c2)cc(C)c1OCC(O)COc1c(C)cc(C(c2ccccc2)(c2ccccc2)c2cc(C)c(OCC3CO3)c(C)c2)cc1C.Cc1cc(Cc2c3ccccc3c(Cc3cc(C)c(OCC4CO4)c(C)c3)c3ccccc23)cc(C)c1OCC(O)COc1c(C)cc(Cc2c3ccccc3c(Cc3cc(C)c(OCC4CO4)c(C)c3)c3ccccc23)cc1C.Cc1cc2cc(-c3ccc4c(C)c(OCC5CO5)c(C)cc4c3)ccc2c(C)c1OCC(O)COc1c(C)cc2cc(-c3ccc4c(C)c(OCC5CO5)c(C)cc4c3)ccc2c1C.c1ccccc1.c1ccccc1
InChIInChI=1S/C73H72O7.C67H68O7.C65H80O7.C57H56O7.2C6H6.C5H12O3.2C4H8O2.8C2H6/c1-43-25-51(33-66-58-17-9-13-21-62(58)68(63-22-14-10-18-59(63)66)35-53-29-47(5)72(48(6)30-53)79-41-56-39-75-56)26-44(2)70(43)77-37-55(74)38-78-71-45(3)27-52(28-46(71)4)34-67-60-19-11-15-23-64(60)69(65-24-16-12-20-61(65)67)36-54-31-49(7)73(50(8)32-54)80-42-57-40-76-57;1-43-29-55(66(51-21-13-9-14-22-51,52-23-15-10-16-24-52)57-33-47(5)64(48(6)34-57)73-41-60-39-69-60)30-44(2)62(43)71-37-59(68)38-72-63-45(3)31-56(32-46(63)4)67(53-25-17-11-18-26-53,54-27-19-12-20-28-54)58-35-49(7)65(50(8)36-58)74-42-61-40-70-61;1-39-25-51(62(9,10)47-17-21-49(22-18-47)64(13,14)53-29-43(5)60(44(6)30-53)71-37-56-35-67-56)26-40(2)58(39)69-33-55(66)34-70-59-41(3)27-52(28-42(59)4)63(11,12)48-19-23-50(24-20-48)65(15,16)54-31-45(7)61(46(8)32-54)72-38-57-36-68-57;1-31-17-43-21-39(41-11-15-52-37(7)56(63-29-48-27-59-48)33(3)19-45(52)23-41)9-13-50(43)35(5)54(31)61-25-47(58)26-62-55-32(2)18-44-22-40(10-14-51(44)36(55)6)42-12-16-53-38(8)57(64-30-49-28-60-49)34(4)20-46(53)24-42;2*1-2-4-6-5-3-1;1-7-3-5(6)4-8-2;2*1-5-2-4-3-6-4;8*1-2/h9-32,55-57,74H,33-42H2,1-8H3;9-36,59-61,68H,37-42H2,1-8H3;17-32,55-57,66H,33-38H2,1-16H3;9-24,47-49,58H,25-30H2,1-8H3;2*1-6H;5-6H,3-4H2,1-2H3;2*4H,2-3H2,1H3;8*1-2H3
InChIKeyJASBUQOIEJBTHK-UHFFFAOYSA-N
MW4566.21 g/mol
LogP66.39
Rot. Bonds82

About benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane)

benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane) (PubChem CID 158861458) has the molecular formula C303H364O35 and a molecular weight of 4566.21 g/mol. Its IUPAC name is benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane).

Molecular Properties

Compound Namebenzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane)
PubChem CID158861458
Molecular FormulaC303H364O35
Molecular Weight4566.21 g/mol
Exact Mass4562.67
IUPAC Namebenzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane)
SMILESCC.CC.CC.CC.CC.CC.CC.CC.COCC(O)COC.COCC1CO1.COCC1CO1.Cc1cc(C(C)(C)c2ccc(C(C)(C)c3cc(C)c(OCC4CO4)c(C)c3)cc2)cc(C)c1OCC(O)COc1c(C)cc(C(C)(C)c2ccc(C(C)(C)c3cc(C)c(OCC4CO4)c(C)c3)cc2)cc1C.Cc1cc(C(c2ccccc2)(c2ccccc2)c2cc(C)c(OCC3CO3)c(C)c2)cc(C)c1OCC(O)COc1c(C)cc(C(c2ccccc2)(c2ccccc2)c2cc(C)c(OCC3CO3)c(C)c2)cc1C.Cc1cc(Cc2c3ccccc3c(Cc3cc(C)c(OCC4CO4)c(C)c3)c3ccccc23)cc(C)c1OCC(O)COc1c(C)cc(Cc2c3ccccc3c(Cc3cc(C)c(OCC4CO4)c(C)c3)c3ccccc23)cc1C.Cc1cc2cc(-c3ccc4c(C)c(OCC5CO5)c(C)cc4c3)ccc2c(C)c1OCC(O)COc1c(C)cc2cc(-c3ccc4c(C)c(OCC5CO5)c(C)cc4c3)ccc2c1C.c1ccccc1.c1ccccc1
InChIInChI=1S/C73H72O7.C67H68O7.C65H80O7.C57H56O7.2C6H6.C5H12O3.2C4H8O2.8C2H6/c1-43-25-51(33-66-58-17-9-13-21-62(58)68(63-22-14-10-18-59(63)66)35-53-29-47(5)72(48(6)30-53)79-41-56-39-75-56)26-44(2)70(43)77-37-55(74)38-78-71-45(3)27-52(28-46(71)4)34-67-60-19-11-15-23-64(60)69(65-24-16-12-20-61(65)67)36-54-31-49(7)73(50(8)32-54)80-42-57-40-76-57;1-43-29-55(66(51-21-13-9-14-22-51,52-23-15-10-16-24-52)57-33-47(5)64(48(6)34-57)73-41-60-39-69-60)30-44(2)62(43)71-37-59(68)38-72-63-45(3)31-56(32-46(63)4)67(53-25-17-11-18-26-53,54-27-19-12-20-28-54)58-35-49(7)65(50(8)36-58)74-42-61-40-70-61;1-39-25-51(62(9,10)47-17-21-49(22-18-47)64(13,14)53-29-43(5)60(44(6)30-53)71-37-56-35-67-56)26-40(2)58(39)69-33-55(66)34-70-59-41(3)27-52(28-42(59)4)63(11,12)48-19-23-50(24-20-48)65(15,16)54-31-45(7)61(46(8)32-54)72-38-57-36-68-57;1-31-17-43-21-39(41-11-15-52-37(7)56(63-29-48-27-59-48)33(3)19-45(52)23-41)9-13-50(43)35(5)54(31)61-25-47(58)26-62-55-32(2)18-44-22-40(10-14-51(44)36(55)6)42-12-16-53-38(8)57(64-30-49-28-60-49)34(4)20-46(53)24-42;2*1-2-4-6-5-3-1;1-7-3-5(6)4-8-2;2*1-5-2-4-3-6-4;8*1-2/h9-32,55-57,74H,33-42H2,1-8H3;9-36,59-61,68H,37-42H2,1-8H3;17-32,55-57,66H,33-38H2,1-16H3;9-24,47-49,58H,25-30H2,1-8H3;2*1-6H;5-6H,3-4H2,1-2H3;2*4H,2-3H2,1H3;8*1-2H3
InChIKeyJASBUQOIEJBTHK-UHFFFAOYSA-N
XLogP66.39
TPSA411.05 Ų
H-Bond Donors5
H-Bond Acceptors35
Rotatable Bonds82
Heavy Atoms338
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004566.21
LogP ≤ 566.39
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1035

Analyze benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane) with MolForge

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Related Compounds

1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[[3-methyl-1-[3-methyl-2-(oxiran-2-ylmethoxy)naphthalen-1-yl]naphthalen-2-yl]oxy]propan-2-ol
CID 159530912
2-[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxymethyl]oxirane;2-[[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]methyl]oxirane
CID 158952710
1,3-bis[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol
CID 58330220
1-[2,6-dibromo-4-[2-[3,5-dibromo-4-(cyclopropylmethoxy)phenyl]propan-2-yl]phenoxy]-3-methoxypropan-2-ol;1-[2,6-dibromo-4-[2-(3,5-dibromo-4-methylphenyl)propan-2-yl]phenoxy]-3-[2,6-dibromo-4-[2-[3,5-dibromo-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol
CID 161393257
1,3-dimethoxypropan-2-ol;ethane;2-(methoxymethyl)oxirane;naphthalene
CID 91108111
1-[4-[2-[4-(cyclopropylmethoxy)phenyl]propan-2-yl]phenoxy]-3-methoxypropan-2-ol;1-[2,6-dibromo-4-[2-(3,5-dibromo-4-methylphenyl)propan-2-yl]phenoxy]-3-[4-[2-[4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol
CID 159997567
1-(4-tert-butylphenoxy)-3-[4-[2-[4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol;2-[(4-methylphenoxy)methyl]oxirane
CID 159135741
1-[4-[2-(4-methoxyphenyl)propan-2-yl]phenoxy]-3-[4-[2-[4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol
CID 18728927
1,3-bis[4-[2-[4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol;methanamine
CID 91550774
1,3-bis[4-[2-[4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol
CID 159105635
2-[[2-[[10-[[3,5-dimethyl-2-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-4,6-dimethylphenoxy]methyl]oxirane
CID 102426138
1,3-bis[4-[2-[4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol;methane
CID 158673985

Frequently Asked Questions

What is the IUPAC name of benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane)?
The IUPAC name of benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane) (CID 158861458) is benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane).
What is the SMILES notation for benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane)?
The canonical SMILES for benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane) is CC.CC.CC.CC.CC.CC.CC.CC.COCC(O)COC.COCC1CO1.COCC1CO1.Cc1cc(C(C)(C)c2ccc(C(C)(C)c3cc(C)c(OCC4CO4)c(C)c3)cc2)cc(C)c1OCC(O)COc1c(C)cc(C(C)(C)c2ccc(C(C)(C)c3cc(C)c(OCC4CO4)c(C)c3)cc2)cc1C.Cc1cc(C(c2ccccc2)(c2ccccc2)c2cc(C)c(OCC3CO3)c(C)c2)cc(C)c1OCC(O)COc1c(C)cc(C(c2ccccc2)(c2ccccc2)c2cc(C)c(OCC3CO3)c(C)c2)cc1C.Cc1cc(Cc2c3ccccc3c(Cc3cc(C)c(OCC4CO4)c(C)c3)c3ccccc23)cc(C)c1OCC(O)COc1c(C)cc(Cc2c3ccccc3c(Cc3cc(C)c(OCC4CO4)c(C)c3)c3ccccc23)cc1C.Cc1cc2cc(-c3ccc4c(C)c(OCC5CO5)c(C)cc4c3)ccc2c(C)c1OCC(O)COc1c(C)cc2cc(-c3ccc4c(C)c(OCC5CO5)c(C)cc4c3)ccc2c1C.c1ccccc1.c1ccccc1.
What is the InChIKey of benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane)?
The InChIKey is JASBUQOIEJBTHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H72O7.C67H68O7.C65H80O7.C57H56O7.2C6H6.C5H12O3.2C4H8O2.8C2H6/c1-43-25-51(33-66-58-17-9-13-21-62(58)68(63-22-14-10-18-59(63)66)35-53-29-47(5)72(48(6)30-53)79-41-56-39-75-56)26-44(2)70(43)77-37-55(74)38-78-71-45(3)27-52(28-46(71)4)34-67-60-19-11-15-23-64(60)69(65-24-16-12-20-61(65)67)36-54-31-49(7)73(50(8)32-54)80-42-57-40-76-57;1-43-29-55(66(51-21-13-9-14-22-51,52-23-15-10-16-24-52)57-33-47(5)64(48(6)34-57)73-41-60-39-69-60)30-44(2)62(43)71-37-59(68)38-72-63-45(3)31-56(32-46(63)4)67(53-25-17-11-18-26-53,54-27-19-12-20-28-54)58-35-49(7)65(50(8)36-58)74-42-61-40-70-61;1-39-25-51(62(9,10)47-17-21-49(22-18-47)64(13,14)53-29-43(5)60(44(6)30-53)71-37-56-35-67-56)26-40(2)58(39)69-33-55(66)34-70-59-41(3)27-52(28-42(59)4)63(11,12)48-19-23-50(24-20-48)65(15,16)54-31-45(7)61(46(8)32-54)72-38-57-36-68-57;1-31-17-43-21-39(41-11-15-52-37(7)56(63-29-48-27-59-48)33(3)19-45(52)23-41)9-13-50(43)35(5)54(31)61-25-47(58)26-62-55-32(2)18-44-22-40(10-14-51(44)36(55)6)42-12-16-53-38(8)57(64-30-49-28-60-49)34(4)20-46(53)24-42;2*1-2-4-6-5-3-1;1-7-3-5(6)4-8-2;2*1-5-2-4-3-6-4;8*1-2/h9-32,55-57,74H,33-42H2,1-8H3;9-36,59-61,68H,37-42H2,1-8H3;17-32,55-57,66H,33-38H2,1-16H3;9-24,47-49,58H,25-30H2,1-8H3;2*1-6H;5-6H,3-4H2,1-2H3;2*4H,2-3H2,1H3;8*1-2H3.
What are the key properties of benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane)?
benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane) has a molecular weight of 4566.21 g/mol, XLogP of 66.39, 82 rotatable bonds, 5 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;1,3-bis[[6-[5,7-dimethyl-6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-1,3-dimethylnaphthalen-2-yl]oxy]propan-2-ol;1,3-bis[4-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]-diphenylmethyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[[10-[[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]methyl]anthracen-9-yl]methyl]-2,6-dimethylphenoxy]propan-2-ol;1,3-bis[4-[2-[4-[2-[3,5-dimethyl-4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenyl]propan-2-yl]-2,6-dimethylphenoxy]propan-2-ol;1,3-dimethoxypropan-2-ol;ethane;bis(2-(methoxymethyl)oxirane) is sourced from PubChem (CID 158861458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).