[9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol

C31H28O2 — CID 118321624

IUPAC[9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol
SMILESOCC1(CCCC2(CO)c3ccccc3-c3ccccc32)c2ccccc2-c2ccccc21
InChIInChI=1S/C31H28O2/c32-20-30(26-14-5-1-10-22(26)23-11-2-6-15-27(23)30)18-9-19-31(21-33)28-16-7-3-12-24(28)25-13-4-8-17-29(25)31/h1-8,10-17,32-33H,9,18-21H2
InChIKeyVDZLKXUWESRASU-UHFFFAOYSA-N
MW432.56 g/mol
LogP6.07
Rot. Bonds6

About [9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol

[9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol (PubChem CID 118321624) has the molecular formula C31H28O2 and a molecular weight of 432.56 g/mol. Its IUPAC name is [9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol.

Molecular Properties

Compound Name[9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol
PubChem CID118321624
Molecular FormulaC31H28O2
Molecular Weight432.56 g/mol
Exact Mass432.21
IUPAC Name[9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol
SMILESOCC1(CCCC2(CO)c3ccccc3-c3ccccc32)c2ccccc2-c2ccccc21
InChIInChI=1S/C31H28O2/c32-20-30(26-14-5-1-10-22(26)23-11-2-6-15-27(23)30)18-9-19-31(21-33)28-16-7-3-12-24(28)25-13-4-8-17-29(25)31/h1-8,10-17,32-33H,9,18-21H2
InChIKeyVDZLKXUWESRASU-UHFFFAOYSA-N
XLogP6.07
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.56
LogP ≤ 56.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;[9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol
CID 144608460
3-[9-[4-[9-(3-aminopropyl)fluoren-9-yl]butyl]fluoren-9-yl]propan-1-amine
CID 90136424
9,9-didecylfluorene
CID 5135289
9,9-di(docosyl)fluorene
CID 22568526
3-[2-[2-[[9-(3-hydroxypropyl)fluoren-9-yl]methyl]phenyl]phenyl]propan-1-ol
CID 118345007
3-[9-(3-amino-3-oxopropyl)fluoren-9-yl]propanamide
CID 156840120
3-[9-(hydroxymethyl)-2-pyren-1-ylfluoren-9-yl]propan-1-ol
CID 90394313
(9-aminofluoren-9-yl)methanol
CID 163585930
2-(9-prop-2-enylfluoren-9-yl)ethanol
CID 11391058
(9-hexylxanthen-9-yl)methanol
CID 59778269
9,9-bis(3-isocyanatopropyl)fluorene
CID 19819910
9,9-dioctylfluorene;ethane;fluoren-9-one;methane
CID 158051918

Frequently Asked Questions

What is the IUPAC name of [9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol?
The IUPAC name of [9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol (CID 118321624) is [9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol.
What is the SMILES notation for [9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol?
The canonical SMILES for [9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol is OCC1(CCCC2(CO)c3ccccc3-c3ccccc32)c2ccccc2-c2ccccc21.
What is the InChIKey of [9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol?
The InChIKey is VDZLKXUWESRASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H28O2/c32-20-30(26-14-5-1-10-22(26)23-11-2-6-15-27(23)30)18-9-19-31(21-33)28-16-7-3-12-24(28)25-13-4-8-17-29(25)31/h1-8,10-17,32-33H,9,18-21H2.
What are the key properties of [9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol?
[9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol has a molecular weight of 432.56 g/mol, XLogP of 6.07, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [9-[3-[9-(hydroxymethyl)fluoren-9-yl]propyl]fluoren-9-yl]methanol is sourced from PubChem (CID 118321624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).