4-[dicyclohexyl(hydroxy)methyl]phenol

C19H28O2 — CID 150013268

IUPAC4-[dicyclohexyl(hydroxy)methyl]phenol
SMILESOc1ccc(C(O)(C2CCCCC2)C2CCCCC2)cc1
InChIInChI=1S/C19H28O2/c20-18-13-11-17(12-14-18)19(21,15-7-3-1-4-8-15)16-9-5-2-6-10-16/h11-16,20-21H,1-10H2
InChIKeyDDSQATWCUZRRCM-UHFFFAOYSA-N
MW288.43 g/mol
LogP4.74
Rot. Bonds3

About 4-[dicyclohexyl(hydroxy)methyl]phenol

4-[dicyclohexyl(hydroxy)methyl]phenol (PubChem CID 150013268) has the molecular formula C19H28O2 and a molecular weight of 288.43 g/mol. Its IUPAC name is 4-[dicyclohexyl(hydroxy)methyl]phenol.

Molecular Properties

Compound Name4-[dicyclohexyl(hydroxy)methyl]phenol
PubChem CID150013268
Molecular FormulaC19H28O2
Molecular Weight288.43 g/mol
Exact Mass288.21
IUPAC Name4-[dicyclohexyl(hydroxy)methyl]phenol
SMILESOc1ccc(C(O)(C2CCCCC2)C2CCCCC2)cc1
InChIInChI=1S/C19H28O2/c20-18-13-11-17(12-14-18)19(21,15-7-3-1-4-8-15)16-9-5-2-6-10-16/h11-16,20-21H,1-10H2
InChIKeyDDSQATWCUZRRCM-UHFFFAOYSA-N
XLogP4.74
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[dicyclohexyl(hydroxy)methyl]phenol?
The IUPAC name of 4-[dicyclohexyl(hydroxy)methyl]phenol (CID 150013268) is 4-[dicyclohexyl(hydroxy)methyl]phenol.
What is the SMILES notation for 4-[dicyclohexyl(hydroxy)methyl]phenol?
The canonical SMILES for 4-[dicyclohexyl(hydroxy)methyl]phenol is Oc1ccc(C(O)(C2CCCCC2)C2CCCCC2)cc1.
What is the InChIKey of 4-[dicyclohexyl(hydroxy)methyl]phenol?
The InChIKey is DDSQATWCUZRRCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28O2/c20-18-13-11-17(12-14-18)19(21,15-7-3-1-4-8-15)16-9-5-2-6-10-16/h11-16,20-21H,1-10H2.
What are the key properties of 4-[dicyclohexyl(hydroxy)methyl]phenol?
4-[dicyclohexyl(hydroxy)methyl]phenol has a molecular weight of 288.43 g/mol, XLogP of 4.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[dicyclohexyl(hydroxy)methyl]phenol is sourced from PubChem (CID 150013268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).