dec-9-en-1-ol;phenylmethanol

C17H28O2 — CID 159433557

IUPACdec-9-en-1-ol;phenylmethanol
SMILESC=CCCCCCCCCO.OCc1ccccc1
InChIInChI=1S/C10H20O.C7H8O/c1-2-3-4-5-6-7-8-9-10-11;8-6-7-4-2-1-3-5-7/h2,11H,1,3-10H2;1-5,8H,6H2
InChIKeyLRHBEHZROUTXJQ-UHFFFAOYSA-N
MW264.41 g/mol
LogP4.07
Rot. Bonds9

About dec-9-en-1-ol;phenylmethanol

dec-9-en-1-ol;phenylmethanol (PubChem CID 159433557) has the molecular formula C17H28O2 and a molecular weight of 264.41 g/mol. Its IUPAC name is dec-9-en-1-ol;phenylmethanol.

Molecular Properties

Compound Namedec-9-en-1-ol;phenylmethanol
PubChem CID159433557
Molecular FormulaC17H28O2
Molecular Weight264.41 g/mol
Exact Mass264.21
IUPAC Namedec-9-en-1-ol;phenylmethanol
SMILESC=CCCCCCCCCO.OCc1ccccc1
InChIInChI=1S/C10H20O.C7H8O/c1-2-3-4-5-6-7-8-9-10-11;8-6-7-4-2-1-3-5-7/h2,11H,1,3-10H2;1-5,8H,6H2
InChIKeyLRHBEHZROUTXJQ-UHFFFAOYSA-N
XLogP4.07
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of dec-9-en-1-ol;phenylmethanol?
The IUPAC name of dec-9-en-1-ol;phenylmethanol (CID 159433557) is dec-9-en-1-ol;phenylmethanol.
What is the SMILES notation for dec-9-en-1-ol;phenylmethanol?
The canonical SMILES for dec-9-en-1-ol;phenylmethanol is C=CCCCCCCCCO.OCc1ccccc1.
What is the InChIKey of dec-9-en-1-ol;phenylmethanol?
The InChIKey is LRHBEHZROUTXJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O.C7H8O/c1-2-3-4-5-6-7-8-9-10-11;8-6-7-4-2-1-3-5-7/h2,11H,1,3-10H2;1-5,8H,6H2.
What are the key properties of dec-9-en-1-ol;phenylmethanol?
dec-9-en-1-ol;phenylmethanol has a molecular weight of 264.41 g/mol, XLogP of 4.07, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dec-9-en-1-ol;phenylmethanol is sourced from PubChem (CID 159433557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).