9-propan-2-yl-4aH-fluorene

C16H16 — CID 59892983

IUPAC9-propan-2-yl-4aH-fluorene
SMILESCC(C)C1=C2C=CC=CC2c2ccccc21
InChIInChI=1S/C16H16/c1-11(2)16-14-9-5-3-7-12(14)13-8-4-6-10-15(13)16/h3-12H,1-2H3
InChIKeyIYTHFNJRLADIFK-UHFFFAOYSA-N
MW208.30 g/mol
LogP4.32
Rot. Bonds1

About 9-propan-2-yl-4aH-fluorene

9-propan-2-yl-4aH-fluorene (PubChem CID 59892983) has the molecular formula C16H16 and a molecular weight of 208.30 g/mol. Its IUPAC name is 9-propan-2-yl-4aH-fluorene.

Molecular Properties

Compound Name9-propan-2-yl-4aH-fluorene
PubChem CID59892983
Molecular FormulaC16H16
Molecular Weight208.30 g/mol
Exact Mass208.13
IUPAC Name9-propan-2-yl-4aH-fluorene
SMILESCC(C)C1=C2C=CC=CC2c2ccccc21
InChIInChI=1S/C16H16/c1-11(2)16-14-9-5-3-7-12(14)13-8-4-6-10-15(13)16/h3-12H,1-2H3
InChIKeyIYTHFNJRLADIFK-UHFFFAOYSA-N
XLogP4.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

9-[1-(8aH-fluoren-9-yl)ethyl]-9H-fluorene;zirconium(2+);dichloride
CID 173217036
ethyl 4-(4aH-fluoren-9-yl)benzoate
CID 67613234
9-[2-(2,4,7-trimethyl-2H-inden-1-yl)ethyl]-4aH-fluorene
CID 135489716
10,19-dimethyltetracyclo[12.4.1.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene
CID 144660686
8aH-fluoren-9-yl-ethenyl-(9H-fluoren-9-yl)-methylsilane;titanium(2+);dichloride
CID 173223274
9-[3-(8aH-fluoren-9-yl)propyl]-9H-fluorene;zirconium(2+);dichloride
CID 173167014
(1S,8R)-13-methylidenetricyclo[6.4.1.02,7]trideca-2,4,6,9,11-pentaene
CID 95564771
10-iodo-9-phenyl-4a,10-dihydroanthracene
CID 129174339
9-[2-(8aH-fluoren-9-yl)-1,2-diphenylethyl]-9H-fluorene;zirconium(2+);dichloride
CID 173317651
8aH-fluoren-9-yl-(9H-fluoren-9-yl)-methyl-prop-1-enylsilane;zirconium(2+);dichloride
CID 173310572
9-[6-(8aH-fluoren-9-yl)decan-5-yl]-9H-fluorene;zirconium(2+);dichloride
CID 173317544
1-[2-[2-(1H-inden-1-yl)phenyl]phenyl]-1H-indene
CID 141431215

Frequently Asked Questions

What is the IUPAC name of 9-propan-2-yl-4aH-fluorene?
The IUPAC name of 9-propan-2-yl-4aH-fluorene (CID 59892983) is 9-propan-2-yl-4aH-fluorene.
What is the SMILES notation for 9-propan-2-yl-4aH-fluorene?
The canonical SMILES for 9-propan-2-yl-4aH-fluorene is CC(C)C1=C2C=CC=CC2c2ccccc21.
What is the InChIKey of 9-propan-2-yl-4aH-fluorene?
The InChIKey is IYTHFNJRLADIFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16/c1-11(2)16-14-9-5-3-7-12(14)13-8-4-6-10-15(13)16/h3-12H,1-2H3.
What are the key properties of 9-propan-2-yl-4aH-fluorene?
9-propan-2-yl-4aH-fluorene has a molecular weight of 208.30 g/mol, XLogP of 4.32, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-propan-2-yl-4aH-fluorene is sourced from PubChem (CID 59892983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).