ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane

C65H61NO2 — CID 158701368

IUPACethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane
SMILESCC.CCC.CCC.Oc1ccc2cc(C3(c4ccc5cc(O)ccc5c4)c4ccccc4-c4ccccc43)ccc2c1.c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C33H22O2.C24H17N.2C3H8.C2H6/c34-27-15-11-21-17-25(13-9-23(21)19-27)33(26-14-10-24-20-28(35)16-12-22(24)18-26)31-7-3-1-5-29(31)30-6-2-4-8-32(30)33;1-2-8-18(9-3-1)19-14-16-20(17-15-19)25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25;2*1-3-2;1-2/h1-20,34-35H;1-17H;2*3H2,1-2H3;1-2H3
InChIKeyIHOWCWAZGCMDGP-UHFFFAOYSA-N
MW888.21 g/mol
LogP18.08
Rot. Bonds4

About ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane

ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane (PubChem CID 158701368) has the molecular formula C65H61NO2 and a molecular weight of 888.21 g/mol. Its IUPAC name is ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane.

Molecular Properties

Compound Nameethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane
PubChem CID158701368
Molecular FormulaC65H61NO2
Molecular Weight888.21 g/mol
Exact Mass887.47
IUPAC Nameethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane
SMILESCC.CCC.CCC.Oc1ccc2cc(C3(c4ccc5cc(O)ccc5c4)c4ccccc4-c4ccccc43)ccc2c1.c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C33H22O2.C24H17N.2C3H8.C2H6/c34-27-15-11-21-17-25(13-9-23(21)19-27)33(26-14-10-24-20-28(35)16-12-22(24)18-26)31-7-3-1-5-29(31)30-6-2-4-8-32(30)33;1-2-8-18(9-3-1)19-14-16-20(17-15-19)25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25;2*1-3-2;1-2/h1-20,34-35H;1-17H;2*3H2,1-2H3;1-2H3
InChIKeyIHOWCWAZGCMDGP-UHFFFAOYSA-N
XLogP18.08
TPSA45.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500888.21
LogP ≤ 518.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 118449222
3-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]-9-[3-[9-[4-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]phenyl]carbazol-3-yl]phenyl]carbazole
CID 146517009
9-[4-[4-[4-[4-[3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]phenyl]phenyl]-3-phenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 134354328
anthracene-1,8-diol;ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;propane
CID 159179801
3-(9-phenylcarbazol-3-yl)-9-[4-[4-[3-[9-[4-(2-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]carbazole
CID 154590784
6-(4-carbazol-9-ylphenyl)naphthalen-2-ol
CID 58460617
3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[3-[4-[4-[3-[9-[3-(4-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590364
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-[4-[4-[3-[9-[4-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590519
5-[4-(4-carbazol-9-ylphenyl)phenyl]-11,11-diphenylindeno[1,2-b]carbazole
CID 168783626
9-phenyl-3-(9-phenylfluoren-9-yl)-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 121311550
4-carbazol-9-yl-N,N-diethylaniline;4-(4-carbazol-9-ylphenyl)-N,N-diethylaniline;bis(9,9-diphenylfluorene);ethane
CID 160998425
3-[9-[4-[3-[4-[3-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 154590573

Frequently Asked Questions

What is the IUPAC name of ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane?
The IUPAC name of ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane (CID 158701368) is ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane.
What is the SMILES notation for ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane?
The canonical SMILES for ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane is CC.CCC.CCC.Oc1ccc2cc(C3(c4ccc5cc(O)ccc5c4)c4ccccc4-c4ccccc43)ccc2c1.c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.
What is the InChIKey of ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane?
The InChIKey is IHOWCWAZGCMDGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H22O2.C24H17N.2C3H8.C2H6/c34-27-15-11-21-17-25(13-9-23(21)19-27)33(26-14-10-24-20-28(35)16-12-22(24)18-26)31-7-3-1-5-29(31)30-6-2-4-8-32(30)33;1-2-8-18(9-3-1)19-14-16-20(17-15-19)25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25;2*1-3-2;1-2/h1-20,34-35H;1-17H;2*3H2,1-2H3;1-2H3.
What are the key properties of ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane?
ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane has a molecular weight of 888.21 g/mol, XLogP of 18.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-[9-(6-hydroxynaphthalen-2-yl)fluoren-9-yl]naphthalen-2-ol;9-(4-phenylphenyl)carbazole;propane is sourced from PubChem (CID 158701368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).