2-ethyldodecan-1-ol

C14H30O — CID 545553

IUPAC2-ethyldodecan-1-ol
SMILESCCCCCCCCCCC(CC)CO
InChIInChI=1S/C14H30O/c1-3-5-6-7-8-9-10-11-12-14(4-2)13-15/h14-15H,3-13H2,1-2H3
InChIKeySBAZXXVUILTVKK-UHFFFAOYSA-N
MW214.39 g/mol
LogP4.54
Rot. Bonds11

About 2-ethyldodecan-1-ol

2-ethyldodecan-1-ol (PubChem CID 545553) has the molecular formula C14H30O and a molecular weight of 214.39 g/mol. Its IUPAC name is 2-ethyldodecan-1-ol.

Molecular Properties

Compound Name2-ethyldodecan-1-ol
PubChem CID545553
Molecular FormulaC14H30O
Molecular Weight214.39 g/mol
Exact Mass214.23
IUPAC Name2-ethyldodecan-1-ol
SMILESCCCCCCCCCCC(CC)CO
InChIInChI=1S/C14H30O/c1-3-5-6-7-8-9-10-11-12-14(4-2)13-15/h14-15H,3-13H2,1-2H3
InChIKeySBAZXXVUILTVKK-UHFFFAOYSA-N
XLogP4.54
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.39
LogP ≤ 54.54
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-ethylhexan-1-ol;2-hexyloctan-1-ol
CID 146216303
2-pentadecylpropane-1,3-diol
CID 91351654
2-nonylundecan-1-ol
CID 14397092
2-tridecylheptadecan-1-ol
CID 22598247
(2S)-2-hexyldodecan-1-ol
CID 73416467
2-pentyldodecan-1-ol
CID 23125768
2-pentyltridecan-1-ol
CID 19896300
2-hexyloctan-1-ol;2-pentylheptan-1-ol
CID 175595463
ethanol;2-heptylnonan-1-ol
CID 122482877
1-Hexanol, 2-ethyl-, magnesium salt (2:1)
CID 74764164
2-ethylhexan-1-ol;hydron
CID 175010288
2-butyloctan-1-ol;2-undecylpentadecan-1-ol
CID 160770857

Frequently Asked Questions

What is the IUPAC name of 2-ethyldodecan-1-ol?
The IUPAC name of 2-ethyldodecan-1-ol (CID 545553) is 2-ethyldodecan-1-ol.
What is the SMILES notation for 2-ethyldodecan-1-ol?
The canonical SMILES for 2-ethyldodecan-1-ol is CCCCCCCCCCC(CC)CO.
What is the InChIKey of 2-ethyldodecan-1-ol?
The InChIKey is SBAZXXVUILTVKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O/c1-3-5-6-7-8-9-10-11-12-14(4-2)13-15/h14-15H,3-13H2,1-2H3.
What are the key properties of 2-ethyldodecan-1-ol?
2-ethyldodecan-1-ol has a molecular weight of 214.39 g/mol, XLogP of 4.54, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyldodecan-1-ol is sourced from PubChem (CID 545553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).