1,4-bis(4-ethylphenyl)-9H-fluorene

C29H26 — CID 101426750

IUPAC1,4-bis(4-ethylphenyl)-9H-fluorene
SMILESCCc1ccc(-c2ccc(-c3ccc(CC)cc3)c3c2Cc2ccccc2-3)cc1
InChIInChI=1S/C29H26/c1-3-20-9-13-22(14-10-20)25-17-18-27(23-15-11-21(4-2)12-16-23)29-26-8-6-5-7-24(26)19-28(25)29/h5-18H,3-4,19H2,1-2H3
InChIKeyRDFGNWLLXAEQRJ-UHFFFAOYSA-N
MW374.53 g/mol
LogP7.72
Rot. Bonds4

About 1,4-bis(4-ethylphenyl)-9H-fluorene

1,4-bis(4-ethylphenyl)-9H-fluorene (PubChem CID 101426750) has the molecular formula C29H26 and a molecular weight of 374.53 g/mol. Its IUPAC name is 1,4-bis(4-ethylphenyl)-9H-fluorene.

Molecular Properties

Compound Name1,4-bis(4-ethylphenyl)-9H-fluorene
PubChem CID101426750
Molecular FormulaC29H26
Molecular Weight374.53 g/mol
Exact Mass374.20
IUPAC Name1,4-bis(4-ethylphenyl)-9H-fluorene
SMILESCCc1ccc(-c2ccc(-c3ccc(CC)cc3)c3c2Cc2ccccc2-3)cc1
InChIInChI=1S/C29H26/c1-3-20-9-13-22(14-10-20)25-17-18-27(23-15-11-21(4-2)12-16-23)29-26-8-6-5-7-24(26)19-28(25)29/h5-18H,3-4,19H2,1-2H3
InChIKeyRDFGNWLLXAEQRJ-UHFFFAOYSA-N
XLogP7.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.53
LogP ≤ 57.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,2-bis(4-ethylphenyl)-9H-fluorene
CID 151520467
4-ethyl-1-[2-(4-ethylphenyl)phenyl]-9H-fluorene
CID 150954424
1,2-bis(4-octadecylphenyl)-9H-fluorene
CID 150394649
1-chloro-4-[2-(4-ethylphenyl)phenyl]benzene
CID 166659313
bis[7-(4-ethylphenyl)-2-phenyl-3H-inden-1-yl]-dimethylsilane
CID 87558709
1,2-diphenyl-9H-fluorene;propanoic acid
CID 174827621
2-ethyl-4-[1-(3-ethyl-4-hydroxyphenyl)-9H-fluoren-2-yl]phenol
CID 141135954
1-ethyl-4-(2-phenylphenyl)benzene;sulfane
CID 160558702
4-[1-(4-aminophenyl)-9H-fluoren-2-yl]aniline
CID 19793996
ethane;1-ethyl-4-(4-ethylphenoxy)benzene;9H-fluorene
CID 158173229
1,1'-biphenyl;4-[1-(4-hydroxyphenyl)-9H-fluoren-2-yl]phenol
CID 174876060
2-ethyl-4-methyl-9H-fluorene
CID 150403501

Frequently Asked Questions

What is the IUPAC name of 1,4-bis(4-ethylphenyl)-9H-fluorene?
The IUPAC name of 1,4-bis(4-ethylphenyl)-9H-fluorene (CID 101426750) is 1,4-bis(4-ethylphenyl)-9H-fluorene.
What is the SMILES notation for 1,4-bis(4-ethylphenyl)-9H-fluorene?
The canonical SMILES for 1,4-bis(4-ethylphenyl)-9H-fluorene is CCc1ccc(-c2ccc(-c3ccc(CC)cc3)c3c2Cc2ccccc2-3)cc1.
What is the InChIKey of 1,4-bis(4-ethylphenyl)-9H-fluorene?
The InChIKey is RDFGNWLLXAEQRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26/c1-3-20-9-13-22(14-10-20)25-17-18-27(23-15-11-21(4-2)12-16-23)29-26-8-6-5-7-24(26)19-28(25)29/h5-18H,3-4,19H2,1-2H3.
What are the key properties of 1,4-bis(4-ethylphenyl)-9H-fluorene?
1,4-bis(4-ethylphenyl)-9H-fluorene has a molecular weight of 374.53 g/mol, XLogP of 7.72, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis(4-ethylphenyl)-9H-fluorene is sourced from PubChem (CID 101426750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).