4-[3-(hydroxymethyl)cyclobutyl]phenol

C11H14O2 — CID 105437523

IUPAC4-[3-(hydroxymethyl)cyclobutyl]phenol
SMILESOCC1CC(c2ccc(O)cc2)C1
InChIInChI=1S/C11H14O2/c12-7-8-5-10(6-8)9-1-3-11(13)4-2-9/h1-4,8,10,12-13H,5-7H2
InChIKeyDLOUGCBJJWXUPM-UHFFFAOYSA-N
MW178.23 g/mol
LogP1.88
Rot. Bonds2

About 4-[3-(hydroxymethyl)cyclobutyl]phenol

4-[3-(hydroxymethyl)cyclobutyl]phenol (PubChem CID 105437523) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 4-[3-(hydroxymethyl)cyclobutyl]phenol.

Molecular Properties

Compound Name4-[3-(hydroxymethyl)cyclobutyl]phenol
PubChem CID105437523
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name4-[3-(hydroxymethyl)cyclobutyl]phenol
SMILESOCC1CC(c2ccc(O)cc2)C1
InChIInChI=1S/C11H14O2/c12-7-8-5-10(6-8)9-1-3-11(13)4-2-9/h1-4,8,10,12-13H,5-7H2
InChIKeyDLOUGCBJJWXUPM-UHFFFAOYSA-N
XLogP1.88
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(1R,4S)-4-(hydroxymethyl)cycloheptyl]phenol
CID 73057394
4-[[2-ethyl-5-[3-hydroxy-5-(hydroxymethyl)cyclohexyl]phenyl]methyl]phenol
CID 145407345
[(1S,3R)-3-(4-bromophenyl)cyclopentyl]methanol
CID 138467946
4-[3-(4-hydroxy-3-methylphenyl)-5-(4-hydroxyphenyl)cyclohexyl]-2-methylphenol
CID 171474669
2-(3-phenylcyclobutyl)ethanol
CID 132580222
4-(6-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)phenol
CID 22384398
4-[4-(2-hydroxyethylidene)cyclohexyl]phenol
CID 118097387
[3-[4-(methylamino)phenyl]cyclohexyl]methanol
CID 172618405
[3-(4-bromophenyl)-5-propan-2-yloxycyclohexyl]methanol;formic acid
CID 172617819
4-(1-methylazetidin-3-yl)phenol
CID 84651703
4-[[[4-(hydroxymethyl)cyclohexyl]amino]methyl]phenol
CID 112753322
4-(3-cyclopentylcyclopentyl)phenol
CID 57025920

Frequently Asked Questions

What is the IUPAC name of 4-[3-(hydroxymethyl)cyclobutyl]phenol?
The IUPAC name of 4-[3-(hydroxymethyl)cyclobutyl]phenol (CID 105437523) is 4-[3-(hydroxymethyl)cyclobutyl]phenol.
What is the SMILES notation for 4-[3-(hydroxymethyl)cyclobutyl]phenol?
The canonical SMILES for 4-[3-(hydroxymethyl)cyclobutyl]phenol is OCC1CC(c2ccc(O)cc2)C1.
What is the InChIKey of 4-[3-(hydroxymethyl)cyclobutyl]phenol?
The InChIKey is DLOUGCBJJWXUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c12-7-8-5-10(6-8)9-1-3-11(13)4-2-9/h1-4,8,10,12-13H,5-7H2.
What are the key properties of 4-[3-(hydroxymethyl)cyclobutyl]phenol?
4-[3-(hydroxymethyl)cyclobutyl]phenol has a molecular weight of 178.23 g/mol, XLogP of 1.88, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(hydroxymethyl)cyclobutyl]phenol is sourced from PubChem (CID 105437523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).