4-(8-hydroxynonan-2-yl)phenol

C15H24O2 — CID 102003793

IUPAC4-(8-hydroxynonan-2-yl)phenol
SMILESCC(O)CCCCCC(C)c1ccc(O)cc1
InChIInChI=1S/C15H24O2/c1-12(6-4-3-5-7-13(2)16)14-8-10-15(17)11-9-14/h8-13,16-17H,3-7H2,1-2H3
InChIKeyPAROLCLUYKUKAZ-UHFFFAOYSA-N
MW236.36 g/mol
LogP3.83
Rot. Bonds7

About 4-(8-hydroxynonan-2-yl)phenol

4-(8-hydroxynonan-2-yl)phenol (PubChem CID 102003793) has the molecular formula C15H24O2 and a molecular weight of 236.36 g/mol. Its IUPAC name is 4-(8-hydroxynonan-2-yl)phenol.

Molecular Properties

Compound Name4-(8-hydroxynonan-2-yl)phenol
PubChem CID102003793
Molecular FormulaC15H24O2
Molecular Weight236.36 g/mol
Exact Mass236.18
IUPAC Name4-(8-hydroxynonan-2-yl)phenol
SMILESCC(O)CCCCCC(C)c1ccc(O)cc1
InChIInChI=1S/C15H24O2/c1-12(6-4-3-5-7-13(2)16)14-8-10-15(17)11-9-14/h8-13,16-17H,3-7H2,1-2H3
InChIKeyPAROLCLUYKUKAZ-UHFFFAOYSA-N
XLogP3.83
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-hexan-2-ylphenol
CID 12579179
4-octan-2-ylphenol;4-octylphenol
CID 157081049
4-[6-(4-hydroxyphenyl)octan-2-yl]phenol
CID 23550616
2,14-diphenylpentadecan-8-ol
CID 71175182
4-(1-hydroxytridecyl)phenol
CID 57120972
4-[1,11,11-tris(4-hydroxyphenyl)undecyl]phenol
CID 57252582
4-[(Z)-hept-5-en-2-yl]phenol
CID 143064321
4-(1-ethoxypropan-2-yl)phenol
CID 91168138
4-hexadecan-7-ylphenol
CID 71320883
4-docosan-2-ylaniline
CID 22757336
5-nonan-2-ylbenzene-1,3-diol
CID 15347172
methane;4-[6-(4-methoxyphenyl)octan-2-yl]phenol
CID 160819739

Frequently Asked Questions

What is the IUPAC name of 4-(8-hydroxynonan-2-yl)phenol?
The IUPAC name of 4-(8-hydroxynonan-2-yl)phenol (CID 102003793) is 4-(8-hydroxynonan-2-yl)phenol.
What is the SMILES notation for 4-(8-hydroxynonan-2-yl)phenol?
The canonical SMILES for 4-(8-hydroxynonan-2-yl)phenol is CC(O)CCCCCC(C)c1ccc(O)cc1.
What is the InChIKey of 4-(8-hydroxynonan-2-yl)phenol?
The InChIKey is PAROLCLUYKUKAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O2/c1-12(6-4-3-5-7-13(2)16)14-8-10-15(17)11-9-14/h8-13,16-17H,3-7H2,1-2H3.
What are the key properties of 4-(8-hydroxynonan-2-yl)phenol?
4-(8-hydroxynonan-2-yl)phenol has a molecular weight of 236.36 g/mol, XLogP of 3.83, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(8-hydroxynonan-2-yl)phenol is sourced from PubChem (CID 102003793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).