1-(4-phenylmethoxyphenyl)hexan-1-ol

C19H24O2 — CID 65145694

IUPAC1-(4-phenylmethoxyphenyl)hexan-1-ol
SMILESCCCCCC(O)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C19H24O2/c1-2-3-5-10-19(20)17-11-13-18(14-12-17)21-15-16-8-6-4-7-9-16/h4,6-9,11-14,19-20H,2-3,5,10,15H2,1H3
InChIKeyRMZBKWZRDJSYBO-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.88
Rot. Bonds8

About 1-(4-phenylmethoxyphenyl)hexan-1-ol

1-(4-phenylmethoxyphenyl)hexan-1-ol (PubChem CID 65145694) has the molecular formula C19H24O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-(4-phenylmethoxyphenyl)hexan-1-ol.

Molecular Properties

Compound Name1-(4-phenylmethoxyphenyl)hexan-1-ol
PubChem CID65145694
Molecular FormulaC19H24O2
Molecular Weight284.40 g/mol
Exact Mass284.18
IUPAC Name1-(4-phenylmethoxyphenyl)hexan-1-ol
SMILESCCCCCC(O)c1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C19H24O2/c1-2-3-5-10-19(20)17-11-13-18(14-12-17)21-15-16-8-6-4-7-9-16/h4,6-9,11-14,19-20H,2-3,5,10,15H2,1H3
InChIKeyRMZBKWZRDJSYBO-UHFFFAOYSA-N
XLogP4.88
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.88
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

1-(4-phenylmethoxyphenyl)heptadecan-1-ol
CID 139807758
(1R)-1-(4-phenylmethoxyphenyl)hexan-1-amine;hydrochloride
CID 171211172
1-(dimethylamino)-2-(4-phenylmethoxyphenyl)octan-3-ol
CID 175328692
(1R,6R)-1,6-bis(4-butoxyphenyl)hexane-1,6-diol
CID 7452438
(1R)-1-(4-phenylmethoxyphenyl)ethane-1,2-diol
CID 71416199
phenoxymethylbenzene;tetradecane
CID 175006528
2-methoxy-1-(4-phenylmethoxyphenyl)ethanol
CID 13050554
octan-3-yl 2-(4-phenylmethoxyphenyl)propanoate
CID 150364577
(1R)-1-phenyloctan-1-ol
CID 12794259
1-hydroxyheptyl 4-phenylmethoxybenzoate
CID 141216856
3-phenyl-1-(4-propoxyphenyl)propan-1-ol
CID 62795595
(2R)-1-[3,5-bis(phenylmethoxy)phenyl]heptan-2-ol
CID 10982342

Frequently Asked Questions

What is the IUPAC name of 1-(4-phenylmethoxyphenyl)hexan-1-ol?
The IUPAC name of 1-(4-phenylmethoxyphenyl)hexan-1-ol (CID 65145694) is 1-(4-phenylmethoxyphenyl)hexan-1-ol.
What is the SMILES notation for 1-(4-phenylmethoxyphenyl)hexan-1-ol?
The canonical SMILES for 1-(4-phenylmethoxyphenyl)hexan-1-ol is CCCCCC(O)c1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 1-(4-phenylmethoxyphenyl)hexan-1-ol?
The InChIKey is RMZBKWZRDJSYBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24O2/c1-2-3-5-10-19(20)17-11-13-18(14-12-17)21-15-16-8-6-4-7-9-16/h4,6-9,11-14,19-20H,2-3,5,10,15H2,1H3.
What are the key properties of 1-(4-phenylmethoxyphenyl)hexan-1-ol?
1-(4-phenylmethoxyphenyl)hexan-1-ol has a molecular weight of 284.40 g/mol, XLogP of 4.88, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenylmethoxyphenyl)hexan-1-ol is sourced from PubChem (CID 65145694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).