9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol

C24H28O5 — CID 154680130

IUPAC9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol
SMILESCC1(O)c2cc(OC3CCCCO3)ccc2-c2ccc(OC3CCCCO3)cc21
InChIInChI=1S/C24H28O5/c1-24(25)20-14-16(28-22-6-2-4-12-26-22)8-10-18(20)19-11-9-17(15-21(19)24)29-23-7-3-5-13-27-23/h8-11,14-15,22-23,25H,2-7,12-13H2,1H3
InChIKeyJZZUXVJIAANIFC-UHFFFAOYSA-N
MW396.48 g/mol
LogP4.73
Rot. Bonds4

About 9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol

9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol (PubChem CID 154680130) has the molecular formula C24H28O5 and a molecular weight of 396.48 g/mol. Its IUPAC name is 9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol.

Molecular Properties

Compound Name9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol
PubChem CID154680130
Molecular FormulaC24H28O5
Molecular Weight396.48 g/mol
Exact Mass396.19
IUPAC Name9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol
SMILESCC1(O)c2cc(OC3CCCCO3)ccc2-c2ccc(OC3CCCCO3)cc21
InChIInChI=1S/C24H28O5/c1-24(25)20-14-16(28-22-6-2-4-12-26-22)8-10-18(20)19-11-9-17(15-21(19)24)29-23-7-3-5-13-27-23/h8-11,14-15,22-23,25H,2-7,12-13H2,1H3
InChIKeyJZZUXVJIAANIFC-UHFFFAOYSA-N
XLogP4.73
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.48
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 10987441
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CID 11745519
CID 168763543
CID 168763543
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2-tert-butyl-4-(oxan-2-yloxy)phenol
CID 12842791
2-[[9-ethynyl-7-(oxan-2-yloxy)-9H-fluoren-2-yl]oxy]oxane
CID 59600964
3-(2-hydroxyethyl)-1,3-dimethyl-5-(oxan-2-yloxy)indol-2-one
CID 11781702
6-[(2R)-oxan-2-yl]oxy-3,4-dihydro-2H-naphthalen-1-one
CID 129395002
trimethyl-[4-(oxan-2-yloxy)phenyl]stannane
CID 11537422
4-(oxan-2-yloxy)benzoic acid
CID 11183645
2-[4-[(E)-4-[4-(oxan-2-yloxy)phenyl]hex-3-en-3-yl]phenoxy]oxane
CID 11339567
3,8-bis[[(2R)-oxan-2-yl]oxy]benzo[c]cinnoline
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Frequently Asked Questions

What is the IUPAC name of 9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol?
The IUPAC name of 9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol (CID 154680130) is 9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol.
What is the SMILES notation for 9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol?
The canonical SMILES for 9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol is CC1(O)c2cc(OC3CCCCO3)ccc2-c2ccc(OC3CCCCO3)cc21.
What is the InChIKey of 9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol?
The InChIKey is JZZUXVJIAANIFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28O5/c1-24(25)20-14-16(28-22-6-2-4-12-26-22)8-10-18(20)19-11-9-17(15-21(19)24)29-23-7-3-5-13-27-23/h8-11,14-15,22-23,25H,2-7,12-13H2,1H3.
What are the key properties of 9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol?
9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol has a molecular weight of 396.48 g/mol, XLogP of 4.73, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-2,7-bis(oxan-2-yloxy)fluoren-9-ol is sourced from PubChem (CID 154680130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).