2-butyl-1-phenyl-9H-fluorene

C23H22 — CID 154085968

IUPAC2-butyl-1-phenyl-9H-fluorene
SMILESCCCCc1ccc2c(c1-c1ccccc1)Cc1ccccc1-2
InChIInChI=1S/C23H22/c1-2-3-9-18-14-15-21-20-13-8-7-12-19(20)16-22(21)23(18)17-10-5-4-6-11-17/h4-8,10-15H,2-3,9,16H2,1H3
InChIKeyIWEFPDDAQTWUKW-UHFFFAOYSA-N
MW298.43 g/mol
LogP6.27
Rot. Bonds4

About 2-butyl-1-phenyl-9H-fluorene

2-butyl-1-phenyl-9H-fluorene (PubChem CID 154085968) has the molecular formula C23H22 and a molecular weight of 298.43 g/mol. Its IUPAC name is 2-butyl-1-phenyl-9H-fluorene.

Molecular Properties

Compound Name2-butyl-1-phenyl-9H-fluorene
PubChem CID154085968
Molecular FormulaC23H22
Molecular Weight298.43 g/mol
Exact Mass298.17
IUPAC Name2-butyl-1-phenyl-9H-fluorene
SMILESCCCCc1ccc2c(c1-c1ccccc1)Cc1ccccc1-2
InChIInChI=1S/C23H22/c1-2-3-9-18-14-15-21-20-13-8-7-12-19(20)16-22(21)23(18)17-10-5-4-6-11-17/h4-8,10-15H,2-3,9,16H2,1H3
InChIKeyIWEFPDDAQTWUKW-UHFFFAOYSA-N
XLogP6.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.43
LogP ≤ 56.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-butyl-2-decyl-9H-fluorene
CID 151429799
1,2-diphenyl-3-propyl-9H-fluorene
CID 174971839
1,2-dihexyl-9H-fluorene
CID 22141601
1,2-bis(4-octadecylphenyl)-9H-fluorene
CID 150394649
1,2-diphenyl-9H-fluorene;propanoic acid
CID 174827621
1-tert-butyl-2-decyl-9H-fluorene
CID 160798357
1,2,3-tributyl-9H-fluorene
CID 90984374
1,3-dibutyl-2-phenylbenzene
CID 15421912
2-fluoro-1-phenyl-9H-fluorene
CID 151671400
4-butyl-2-(9H-fluoren-1-yl)-3-octylphenol
CID 150998835
4-(9H-fluoren-1-yl)-2,6-dioctadecylphenol
CID 151971202
2-butyl-4-(9H-fluoren-1-yl)phenol
CID 139434152

Frequently Asked Questions

What is the IUPAC name of 2-butyl-1-phenyl-9H-fluorene?
The IUPAC name of 2-butyl-1-phenyl-9H-fluorene (CID 154085968) is 2-butyl-1-phenyl-9H-fluorene.
What is the SMILES notation for 2-butyl-1-phenyl-9H-fluorene?
The canonical SMILES for 2-butyl-1-phenyl-9H-fluorene is CCCCc1ccc2c(c1-c1ccccc1)Cc1ccccc1-2.
What is the InChIKey of 2-butyl-1-phenyl-9H-fluorene?
The InChIKey is IWEFPDDAQTWUKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22/c1-2-3-9-18-14-15-21-20-13-8-7-12-19(20)16-22(21)23(18)17-10-5-4-6-11-17/h4-8,10-15H,2-3,9,16H2,1H3.
What are the key properties of 2-butyl-1-phenyl-9H-fluorene?
2-butyl-1-phenyl-9H-fluorene has a molecular weight of 298.43 g/mol, XLogP of 6.27, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-1-phenyl-9H-fluorene is sourced from PubChem (CID 154085968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).