bis(9,9-diphenylfluorene);ethane;propane

C55H50 — CID 144938803

IUPACbis(9,9-diphenylfluorene);ethane;propane
SMILESCC.CCC.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/2C25H18.C3H8.C2H6/c2*1-3-11-19(12-4-1)25(20-13-5-2-6-14-20)23-17-9-7-15-21(23)22-16-8-10-18-24(22)25;1-3-2;1-2/h2*1-18H;3H2,1-2H3;1-2H3
InChIKeyHBCWSVXYEWAWAQ-UHFFFAOYSA-N
MW711.00 g/mol
LogP14.54
Rot. Bonds4

About bis(9,9-diphenylfluorene);ethane;propane

bis(9,9-diphenylfluorene);ethane;propane (PubChem CID 144938803) has the molecular formula C55H50 and a molecular weight of 711.00 g/mol. Its IUPAC name is bis(9,9-diphenylfluorene);ethane;propane.

Molecular Properties

Compound Namebis(9,9-diphenylfluorene);ethane;propane
PubChem CID144938803
Molecular FormulaC55H50
Molecular Weight711.00 g/mol
Exact Mass710.39
IUPAC Namebis(9,9-diphenylfluorene);ethane;propane
SMILESCC.CCC.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/2C25H18.C3H8.C2H6/c2*1-3-11-19(12-4-1)25(20-13-5-2-6-14-20)23-17-9-7-15-21(23)22-16-8-10-18-24(22)25;1-3-2;1-2/h2*1-18H;3H2,1-2H3;1-2H3
InChIKeyHBCWSVXYEWAWAQ-UHFFFAOYSA-N
XLogP14.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500711.00
LogP ≤ 514.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

9,9-diphenylfluorene;propane
CID 158205050
9,9-diphenylfluorene;methane
CID 145331804
9,9-diphenylfluorene;methane
CID 145140147
propane;spiro[fluorene-9,6'-tricyclo[5.2.2.22,5]trideca-1(10),2(13),3,5(12),7(11),8-hexaene]
CID 144938761
9,9-diphenylfluorene;methoxymethane
CID 143139467
9-(4-ethylphenyl)-9-phenylfluorene
CID 149284542
9,9-bis(4-methylphenyl)fluorene;propane
CID 144938703
9-(4-ethoxyphenyl)-9-phenylfluorene
CID 135250989
tetrakis(9,9-dimethylfluorene);tetrakis(9,9-diphenylfluorene);ethane;toluene
CID 157389689
9,9-diphenylfluorene;ethane;fluoro(sulfanylidene)borane;methane;9,9'-spirobi[fluorene]
CID 160740129
9,9-dimethylfluorene;tris(N,N-dimethylmethanamine);9,9-diphenylfluorene;ethane;tetrakis(9,9'-spirobi[fluorene])
CID 161352369
9,9-diphenylfluorene;N-[(9,9-diphenylfluoren-2-yl)methyl]-N-ethylethanamine;ethane
CID 157306926

Frequently Asked Questions

What is the IUPAC name of bis(9,9-diphenylfluorene);ethane;propane?
The IUPAC name of bis(9,9-diphenylfluorene);ethane;propane (CID 144938803) is bis(9,9-diphenylfluorene);ethane;propane.
What is the SMILES notation for bis(9,9-diphenylfluorene);ethane;propane?
The canonical SMILES for bis(9,9-diphenylfluorene);ethane;propane is CC.CCC.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of bis(9,9-diphenylfluorene);ethane;propane?
The InChIKey is HBCWSVXYEWAWAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C25H18.C3H8.C2H6/c2*1-3-11-19(12-4-1)25(20-13-5-2-6-14-20)23-17-9-7-15-21(23)22-16-8-10-18-24(22)25;1-3-2;1-2/h2*1-18H;3H2,1-2H3;1-2H3.
What are the key properties of bis(9,9-diphenylfluorene);ethane;propane?
bis(9,9-diphenylfluorene);ethane;propane has a molecular weight of 711.00 g/mol, XLogP of 14.54, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(9,9-diphenylfluorene);ethane;propane is sourced from PubChem (CID 144938803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).