8-phenyl-5-propan-2-yloxyoctan-1-ol

C17H28O2 — CID 11173113

IUPAC8-phenyl-5-propan-2-yloxyoctan-1-ol
SMILESCC(C)OC(CCCCO)CCCc1ccccc1
InChIInChI=1S/C17H28O2/c1-15(2)19-17(12-6-7-14-18)13-8-11-16-9-4-3-5-10-16/h3-5,9-10,15,17-18H,6-8,11-14H2,1-2H3
InChIKeyCTKLWVZUWNCJLK-UHFFFAOYSA-N
MW264.41 g/mol
LogP3.97
Rot. Bonds10

About 8-phenyl-5-propan-2-yloxyoctan-1-ol

8-phenyl-5-propan-2-yloxyoctan-1-ol (PubChem CID 11173113) has the molecular formula C17H28O2 and a molecular weight of 264.41 g/mol. Its IUPAC name is 8-phenyl-5-propan-2-yloxyoctan-1-ol.

Molecular Properties

Compound Name8-phenyl-5-propan-2-yloxyoctan-1-ol
PubChem CID11173113
Molecular FormulaC17H28O2
Molecular Weight264.41 g/mol
Exact Mass264.21
IUPAC Name8-phenyl-5-propan-2-yloxyoctan-1-ol
SMILESCC(C)OC(CCCCO)CCCc1ccccc1
InChIInChI=1S/C17H28O2/c1-15(2)19-17(12-6-7-14-18)13-8-11-16-9-4-3-5-10-16/h3-5,9-10,15,17-18H,6-8,11-14H2,1-2H3
InChIKeyCTKLWVZUWNCJLK-UHFFFAOYSA-N
XLogP3.97
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

13-phenyl-4-phenylmethoxytridecan-1-ol
CID 15735700
(9-hydroxy-1-phenylnonan-3-yl) acetate
CID 10850236
1-phenylnonan-4-yl hydrogen carbonate
CID 67178650
3-phenyl-2-propan-2-yloxypropan-1-ol
CID 174505154
1-phenyloctan-4-yloxysilane
CID 123554826
N-methylmethanamine;3-phenylpropan-1-ol
CID 174893841
5-phenyl-1-propan-2-yloxypentan-2-ol
CID 14984664
4-phenylmethoxynonadecan-1-ol
CID 15735676
3-methyl-6-phenylhexan-2-ol
CID 54498182
decan-2-yloxy-(3-hydroxypropyl)-(6-phenylhexyl)sulfanium
CID 172720647
1-phenylpentadecan-7-yl hydrogen carbonate
CID 67178943
13-phenyltridecan-6-yl hydrogen carbonate
CID 67181193

Frequently Asked Questions

What is the IUPAC name of 8-phenyl-5-propan-2-yloxyoctan-1-ol?
The IUPAC name of 8-phenyl-5-propan-2-yloxyoctan-1-ol (CID 11173113) is 8-phenyl-5-propan-2-yloxyoctan-1-ol.
What is the SMILES notation for 8-phenyl-5-propan-2-yloxyoctan-1-ol?
The canonical SMILES for 8-phenyl-5-propan-2-yloxyoctan-1-ol is CC(C)OC(CCCCO)CCCc1ccccc1.
What is the InChIKey of 8-phenyl-5-propan-2-yloxyoctan-1-ol?
The InChIKey is CTKLWVZUWNCJLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28O2/c1-15(2)19-17(12-6-7-14-18)13-8-11-16-9-4-3-5-10-16/h3-5,9-10,15,17-18H,6-8,11-14H2,1-2H3.
What are the key properties of 8-phenyl-5-propan-2-yloxyoctan-1-ol?
8-phenyl-5-propan-2-yloxyoctan-1-ol has a molecular weight of 264.41 g/mol, XLogP of 3.97, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-phenyl-5-propan-2-yloxyoctan-1-ol is sourced from PubChem (CID 11173113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).