2-ethyl-2-phenyldecan-1-ol

C18H30O — CID 66058928

IUPAC2-ethyl-2-phenyldecan-1-ol
SMILESCCCCCCCCC(CC)(CO)c1ccccc1
InChIInChI=1S/C18H30O/c1-3-5-6-7-8-12-15-18(4-2,16-19)17-13-10-9-11-14-17/h9-11,13-14,19H,3-8,12,15-16H2,1-2H3
InChIKeyXOCDQHVHPGUAIG-UHFFFAOYSA-N
MW262.44 g/mol
LogP5.08
Rot. Bonds10

About 2-ethyl-2-phenyldecan-1-ol

2-ethyl-2-phenyldecan-1-ol (PubChem CID 66058928) has the molecular formula C18H30O and a molecular weight of 262.44 g/mol. Its IUPAC name is 2-ethyl-2-phenyldecan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-phenyldecan-1-ol
PubChem CID66058928
Molecular FormulaC18H30O
Molecular Weight262.44 g/mol
Exact Mass262.23
IUPAC Name2-ethyl-2-phenyldecan-1-ol
SMILESCCCCCCCCC(CC)(CO)c1ccccc1
InChIInChI=1S/C18H30O/c1-3-5-6-7-8-12-15-18(4-2,16-19)17-13-10-9-11-14-17/h9-11,13-14,19H,3-8,12,15-16H2,1-2H3
InChIKeyXOCDQHVHPGUAIG-UHFFFAOYSA-N
XLogP5.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.44
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-ethyl-2-phenylnonan-1-ol
CID 66057887
2-butyl-2-phenylpropane-1,3-diol
CID 79449681
5-butylhexadecan-5-ylbenzene
CID 173084700
3-(chloromethyl)undecan-3-ylbenzene
CID 66033821
N,2-diethyl-2-phenyldecan-1-amine
CID 63507626
4-amino-2-ethyl-2-phenylbutan-1-ol;ethane
CID 143493864
2-heptyl-2-(4-methylphenyl)propane-1,3-diol
CID 79450135
1,3-bis(3-ethyldodecan-3-yl)benzene
CID 150177069
(8-nonyl-8-phenylheptadecyl) dihydrogen phosphate
CID 141475545
2-(8-ethylpentadecan-8-yl)phenol
CID 87184015
2-(11-ethylhenicosan-11-yl)phenol
CID 87183827
15-phenylnonacosan-15-ylbenzene
CID 141310981

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-phenyldecan-1-ol?
The IUPAC name of 2-ethyl-2-phenyldecan-1-ol (CID 66058928) is 2-ethyl-2-phenyldecan-1-ol.
What is the SMILES notation for 2-ethyl-2-phenyldecan-1-ol?
The canonical SMILES for 2-ethyl-2-phenyldecan-1-ol is CCCCCCCCC(CC)(CO)c1ccccc1.
What is the InChIKey of 2-ethyl-2-phenyldecan-1-ol?
The InChIKey is XOCDQHVHPGUAIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30O/c1-3-5-6-7-8-12-15-18(4-2,16-19)17-13-10-9-11-14-17/h9-11,13-14,19H,3-8,12,15-16H2,1-2H3.
What are the key properties of 2-ethyl-2-phenyldecan-1-ol?
2-ethyl-2-phenyldecan-1-ol has a molecular weight of 262.44 g/mol, XLogP of 5.08, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-phenyldecan-1-ol is sourced from PubChem (CID 66058928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).