1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene

C24H24O — CID 175394997

IUPAC1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene
SMILESCCOc1ccc(-c2cccc3c2Cc2ccccc2-3)cc1C(C)C
InChIInChI=1S/C24H24O/c1-4-25-24-13-12-18(14-22(24)16(2)3)20-10-7-11-21-19-9-6-5-8-17(19)15-23(20)21/h5-14,16H,4,15H2,1-3H3
InChIKeyAUNUFIKBVZOALU-UHFFFAOYSA-N
MW328.46 g/mol
LogP6.45
Rot. Bonds4

About 1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene

1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene (PubChem CID 175394997) has the molecular formula C24H24O and a molecular weight of 328.46 g/mol. Its IUPAC name is 1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene.

Molecular Properties

Compound Name1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene
PubChem CID175394997
Molecular FormulaC24H24O
Molecular Weight328.46 g/mol
Exact Mass328.18
IUPAC Name1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene
SMILESCCOc1ccc(-c2cccc3c2Cc2ccccc2-3)cc1C(C)C
InChIInChI=1S/C24H24O/c1-4-25-24-13-12-18(14-22(24)16(2)3)20-10-7-11-21-19-9-6-5-8-17(19)15-23(20)21/h5-14,16H,4,15H2,1-3H3
InChIKeyAUNUFIKBVZOALU-UHFFFAOYSA-N
XLogP6.45
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.46
LogP ≤ 56.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-(9H-fluoren-1-yl)-2-methylphenoxy]ethanol
CID 66730243
2-[2,6-di(butan-2-yl)-4-(9H-fluoren-1-yl)phenoxy]ethanol
CID 67661007
1-[2,3-di(propan-2-yl)phenyl]-9H-fluorene
CID 151273743
2-ethoxy-1-naphthalen-1-yl-9H-fluorene
CID 91339111
[4-(9H-fluoren-1-yl)-2-methylphenyl] cyanate
CID 159261895
2,11-bis(9H-fluoren-1-yl)triphenylene
CID 59489264
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
2-(9H-fluoren-1-yl)anthracene
CID 151119003
2-[2-[4-(9H-fluoren-1-yl)-2-methylphenoxy]ethoxymethyl]thiirane
CID 170317959
1-(3,5-dimethoxyphenyl)-9H-fluorene
CID 152594732
1-[3-(3-methylphenyl)phenyl]-9H-fluorene
CID 159755340
2-butyl-4-(9H-fluoren-1-yl)phenol
CID 139434152

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene?
The IUPAC name of 1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene (CID 175394997) is 1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene.
What is the SMILES notation for 1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene?
The canonical SMILES for 1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene is CCOc1ccc(-c2cccc3c2Cc2ccccc2-3)cc1C(C)C.
What is the InChIKey of 1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene?
The InChIKey is AUNUFIKBVZOALU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24O/c1-4-25-24-13-12-18(14-22(24)16(2)3)20-10-7-11-21-19-9-6-5-8-17(19)15-23(20)21/h5-14,16H,4,15H2,1-3H3.
What are the key properties of 1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene?
1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene has a molecular weight of 328.46 g/mol, XLogP of 6.45, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxy-3-propan-2-ylphenyl)-9H-fluorene is sourced from PubChem (CID 175394997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).