10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane

C191H142O16S — CID 160778239

IUPAC10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane
SMILESC=COc1ccc2cc(C3(c4ccc5cc(OC=C)ccc5c4)c4ccccc4Cc4ccccc43)ccc2c1.C=COc1ccc2cc(C3(c4ccc5cc(OC=C)ccc5c4)c4ccccc4Oc4ccccc43)ccc2c1.C=COc1ccc2cc(C3(c4ccc5cc(OC=C)ccc5c4)c4ccccc4Sc4ccccc43)ccc2c1.c1ccc2c(c1)Cc1ccccc1C2(c1ccc2cc(OCC3CO3)ccc2c1)c1ccc2cc(OCC3CO3)ccc2c1.c1ccc2c(c1)Oc1ccccc1C2(c1ccc2cc(OCC3CO3)ccc2c1)c1ccc2cc(OCC3CO3)ccc2c1
InChIInChI=1S/C40H32O4.C39H30O5.C38H28O2.C37H26O3.C37H26O2S/c1-3-7-38-30(5-1)17-31-6-2-4-8-39(31)40(38,32-13-9-28-20-34(15-11-26(28)18-32)41-22-36-24-43-36)33-14-10-29-21-35(16-12-27(29)19-33)42-23-37-25-44-37;1-3-7-37-35(5-1)39(36-6-2-4-8-38(36)44-37,29-13-9-27-19-31(15-11-25(27)17-29)40-21-33-23-42-33)30-14-10-28-20-32(16-12-26(28)18-30)41-22-34-24-43-34;1-3-39-34-19-15-26-22-32(17-13-28(26)24-34)38(33-18-14-29-25-35(40-4-2)20-16-27(29)23-33)36-11-7-5-9-30(36)21-31-10-6-8-12-37(31)38;2*1-3-38-31-19-15-25-21-29(17-13-27(25)23-31)37(30-18-14-28-24-32(39-4-2)20-16-26(28)22-30)33-9-5-7-11-35(33)40-36-12-8-6-10-34(36)37/h1-16,18-21,36-37H,17,22-25H2;1-20,33-34H,21-24H2;3-20,22-25H,1-2,21H2;2*3-24H,1-2H2
InChIKeySAFSSEOBLALUOQ-UHFFFAOYSA-N
MW2725.29 g/mol
LogP44.61
Rot. Bonds34

About 10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane

10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane (PubChem CID 160778239) has the molecular formula C191H142O16S and a molecular weight of 2725.29 g/mol. Its IUPAC name is 10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane.

Molecular Properties

Compound Name10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane
PubChem CID160778239
Molecular FormulaC191H142O16S
Molecular Weight2725.29 g/mol
Exact Mass2723.00
IUPAC Name10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane
SMILESC=COc1ccc2cc(C3(c4ccc5cc(OC=C)ccc5c4)c4ccccc4Cc4ccccc43)ccc2c1.C=COc1ccc2cc(C3(c4ccc5cc(OC=C)ccc5c4)c4ccccc4Oc4ccccc43)ccc2c1.C=COc1ccc2cc(C3(c4ccc5cc(OC=C)ccc5c4)c4ccccc4Sc4ccccc43)ccc2c1.c1ccc2c(c1)Cc1ccccc1C2(c1ccc2cc(OCC3CO3)ccc2c1)c1ccc2cc(OCC3CO3)ccc2c1.c1ccc2c(c1)Oc1ccccc1C2(c1ccc2cc(OCC3CO3)ccc2c1)c1ccc2cc(OCC3CO3)ccc2c1
InChIInChI=1S/C40H32O4.C39H30O5.C38H28O2.C37H26O3.C37H26O2S/c1-3-7-38-30(5-1)17-31-6-2-4-8-39(31)40(38,32-13-9-28-20-34(15-11-26(28)18-32)41-22-36-24-43-36)33-14-10-29-21-35(16-12-27(29)19-33)42-23-37-25-44-37;1-3-7-37-35(5-1)39(36-6-2-4-8-38(36)44-37,29-13-9-27-19-31(15-11-25(27)17-29)40-21-33-23-42-33)30-14-10-28-20-32(16-12-26(28)18-30)41-22-34-24-43-34;1-3-39-34-19-15-26-22-32(17-13-28(26)24-34)38(33-18-14-29-25-35(40-4-2)20-16-27(29)23-33)36-11-7-5-9-30(36)21-31-10-6-8-12-37(31)38;2*1-3-38-31-19-15-25-21-29(17-13-27(25)23-31)37(30-18-14-28-24-32(39-4-2)20-16-26(28)22-30)33-9-5-7-11-35(33)40-36-12-8-6-10-34(36)37/h1-16,18-21,36-37H,17,22-25H2;1-20,33-34H,21-24H2;3-20,22-25H,1-2,21H2;2*3-24H,1-2H2
InChIKeySAFSSEOBLALUOQ-UHFFFAOYSA-N
XLogP44.61
TPSA160.88 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds34
Heavy Atoms208
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002725.29
LogP ≤ 544.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze 10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane with MolForge

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Related Compounds

9-(6-ethenoxynaphthalen-2-yl)-9-[6-[(1E,3E)-4-[4-[9-(4-ethenoxyphenyl)-10H-anthracen-9-yl]phenoxy]buta-1,3-dienoxy]naphthalen-2-yl]thioxanthene
CID 174040044
9,9-bis[4-(thiiran-2-ylmethoxy)phenyl]thioxanthene;9,9-bis[4-(thiiran-2-ylmethoxy)phenyl]xanthene;2-[[4-[9-[4-(thiiran-2-ylmethoxy)phenyl]-10H-anthracen-9-yl]phenoxy]methyl]thiirane
CID 159728795
9,9-bis[6-(thiiran-2-ylmethoxy)naphthalen-2-yl]xanthene
CID 137456468
2-[[6-[12-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-12-pentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaenyl]naphthalen-2-yl]oxymethyl]oxirane
CID 140948259
2-[[6-[9,18,18,27,27-pentakis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-9-heptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1(20),2(10),3,5,7,11(19),12,14,16,21,23,25-dodecaenyl]naphthalen-2-yl]oxymethyl]oxirane
CID 89491365
(2S)-2-(naphthalen-2-yloxymethyl)oxirane
CID 726163
10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;11,11-bis(4-ethenoxyphenyl)benzo[a]fluorene;12,12-bis(4-ethenoxyphenyl)pentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;12,12-bis(4-ethenoxyphenyl)pentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene;12,12-bis(4-ethenoxyphenyl)pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaene;12,12-bis(4-ethenoxyphenyl)pentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene
CID 158885777
spiro[thioxanthene-9,9'-xanthene]
CID 59096341
2-[[6-[12-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-12-pentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaenyl]naphthalen-2-yl]oxymethyl]oxirane;2-[[6-[12-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-12-pentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaenyl]naphthalen-2-yl]oxymethyl]oxirane;2-[[6-[12-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-12-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaenyl]naphthalen-2-yl]oxymethyl]oxirane;2-[[6-[11-[6-(thiiran-2-ylmethoxy)naphthalen-2-yl]benzo[b]fluoren-11-yl]naphthalen-2-yl]oxymethyl]thiirane;2-[[6-[12-[6-(thiiran-2-ylmethoxy)naphthalen-2-yl]-12-pentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaenyl]naphthalen-2-yl]oxymethyl]thiirane
CID 159101774
9-(6-but-2-ynoxynaphthalen-2-yl)-9-[4-[4-[9-(6-but-2-ynoxynaphthalen-2-yl)xanthen-9-yl]phenyl]sulfanylphenyl]xanthene
CID 153299422
2-[[4-[9-[4-(cyclopropylmethoxy)phenyl]fluoren-9-yl]phenoxy]methyl]oxirane
CID 88858743
2-[2-[4-[11-[4-[2-(oxiran-2-ylmethoxy)ethoxy]phenyl]benzo[b]fluoren-11-yl]phenoxy]ethoxymethyl]oxirane;2-[[4-[11-[4-(oxiran-2-ylmethoxy)phenyl]benzo[b]fluoren-11-yl]phenoxy]methyl]oxirane
CID 164953696

Frequently Asked Questions

What is the IUPAC name of 10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane?
The IUPAC name of 10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane (CID 160778239) is 10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane.
What is the SMILES notation for 10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane?
The canonical SMILES for 10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane is C=COc1ccc2cc(C3(c4ccc5cc(OC=C)ccc5c4)c4ccccc4Cc4ccccc43)ccc2c1.C=COc1ccc2cc(C3(c4ccc5cc(OC=C)ccc5c4)c4ccccc4Oc4ccccc43)ccc2c1.C=COc1ccc2cc(C3(c4ccc5cc(OC=C)ccc5c4)c4ccccc4Sc4ccccc43)ccc2c1.c1ccc2c(c1)Cc1ccccc1C2(c1ccc2cc(OCC3CO3)ccc2c1)c1ccc2cc(OCC3CO3)ccc2c1.c1ccc2c(c1)Oc1ccccc1C2(c1ccc2cc(OCC3CO3)ccc2c1)c1ccc2cc(OCC3CO3)ccc2c1.
What is the InChIKey of 10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane?
The InChIKey is SAFSSEOBLALUOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H32O4.C39H30O5.C38H28O2.C37H26O3.C37H26O2S/c1-3-7-38-30(5-1)17-31-6-2-4-8-39(31)40(38,32-13-9-28-20-34(15-11-26(28)18-32)41-22-36-24-43-36)33-14-10-29-21-35(16-12-27(29)19-33)42-23-37-25-44-37;1-3-7-37-35(5-1)39(36-6-2-4-8-38(36)44-37,29-13-9-27-19-31(15-11-25(27)17-29)40-21-33-23-42-33)30-14-10-28-20-32(16-12-26(28)18-30)41-22-34-24-43-34;1-3-39-34-19-15-26-22-32(17-13-28(26)24-34)38(33-18-14-29-25-35(40-4-2)20-16-27(29)23-33)36-11-7-5-9-30(36)21-31-10-6-8-12-37(31)38;2*1-3-38-31-19-15-25-21-29(17-13-27(25)23-31)37(30-18-14-28-24-32(39-4-2)20-16-26(28)22-30)33-9-5-7-11-35(33)40-36-12-8-6-10-34(36)37/h1-16,18-21,36-37H,17,22-25H2;1-20,33-34H,21-24H2;3-20,22-25H,1-2,21H2;2*3-24H,1-2H2.
What are the key properties of 10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane?
10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane has a molecular weight of 2725.29 g/mol, XLogP of 44.61, 34 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10-bis(6-ethenoxynaphthalen-2-yl)-9H-anthracene;9,9-bis(6-ethenoxynaphthalen-2-yl)thioxanthene;9,9-bis(6-ethenoxynaphthalen-2-yl)xanthene;9,9-bis[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]xanthene;2-[[6-[9-[6-(oxiran-2-ylmethoxy)naphthalen-2-yl]-10H-anthracen-9-yl]naphthalen-2-yl]oxymethyl]oxirane is sourced from PubChem (CID 160778239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).