2,6-di(cyclobutyl)phenol

C14H18O — CID 57426118

IUPAC2,6-di(cyclobutyl)phenol
SMILESOc1c(C2CCC2)cccc1C1CCC1
InChIInChI=1S/C14H18O/c15-14-12(10-4-1-5-10)8-3-9-13(14)11-6-2-7-11/h3,8-11,15H,1-2,4-7H2
InChIKeyFVYQGCRSDKPZIK-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.93
Rot. Bonds2

About 2,6-di(cyclobutyl)phenol

2,6-di(cyclobutyl)phenol (PubChem CID 57426118) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is 2,6-di(cyclobutyl)phenol.

Molecular Properties

Compound Name2,6-di(cyclobutyl)phenol
PubChem CID57426118
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name2,6-di(cyclobutyl)phenol
SMILESOc1c(C2CCC2)cccc1C1CCC1
InChIInChI=1S/C14H18O/c15-14-12(10-4-1-5-10)8-3-9-13(14)11-6-2-7-11/h3,8-11,15H,1-2,4-7H2
InChIKeyFVYQGCRSDKPZIK-UHFFFAOYSA-N
XLogP3.93
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-cyclopentyl-2-hydroxycyclohepta-2,4,6-trien-1-one
CID 146178995
2,6-di(cyclobutyl)aniline
CID 172550384
2-cyclohexyl-6-propan-2-ylphenol
CID 3058302
2-cyclododecylphenol
CID 22381643
3-cyclohexyl-6-methylbenzene-1,2-diol
CID 150190518
2,6-dicyclohexyl-3-methylphenol
CID 3022567
2-tert-butyl-6-cyclopropylphenol
CID 139975684
2-[(1R)-1-amino-2-hydroxyethyl]-6-cyclohexylphenol
CID 66514859
2,6-di(cyclobutyl)-4-[3,5-di(cyclobutyl)-4-hydroxyphenyl]sulfanylphenol
CID 172825443
3-cyclopropyl-2-hydroxycyclohepta-2,4,6-trien-1-one
CID 157394257
2-bromo-6-piperidin-4-ylphenol
CID 82623407
(2,3-dichlorophenyl)cycloheptane
CID 166869288

Frequently Asked Questions

What is the IUPAC name of 2,6-di(cyclobutyl)phenol?
The IUPAC name of 2,6-di(cyclobutyl)phenol (CID 57426118) is 2,6-di(cyclobutyl)phenol.
What is the SMILES notation for 2,6-di(cyclobutyl)phenol?
The canonical SMILES for 2,6-di(cyclobutyl)phenol is Oc1c(C2CCC2)cccc1C1CCC1.
What is the InChIKey of 2,6-di(cyclobutyl)phenol?
The InChIKey is FVYQGCRSDKPZIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O/c15-14-12(10-4-1-5-10)8-3-9-13(14)11-6-2-7-11/h3,8-11,15H,1-2,4-7H2.
What are the key properties of 2,6-di(cyclobutyl)phenol?
2,6-di(cyclobutyl)phenol has a molecular weight of 202.30 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-di(cyclobutyl)phenol is sourced from PubChem (CID 57426118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).