2-(2-hydroxyethyl)tetradecanoic acid

C16H32O3 — CID 54117326

IUPAC2-(2-hydroxyethyl)tetradecanoic acid
SMILESCCCCCCCCCCCCC(CCO)C(=O)O
InChIInChI=1S/C16H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-15(13-14-17)16(18)19/h15,17H,2-14H2,1H3,(H,18,19)
InChIKeyCBBPCTUZWQXJDG-UHFFFAOYSA-N
MW272.43 g/mol
LogP4.38
Rot. Bonds14

About 2-(2-hydroxyethyl)tetradecanoic acid

2-(2-hydroxyethyl)tetradecanoic acid (PubChem CID 54117326) has the molecular formula C16H32O3 and a molecular weight of 272.43 g/mol. Its IUPAC name is 2-(2-hydroxyethyl)tetradecanoic acid.

Molecular Properties

Compound Name2-(2-hydroxyethyl)tetradecanoic acid
PubChem CID54117326
Molecular FormulaC16H32O3
Molecular Weight272.43 g/mol
Exact Mass272.24
IUPAC Name2-(2-hydroxyethyl)tetradecanoic acid
SMILESCCCCCCCCCCCCC(CCO)C(=O)O
InChIInChI=1S/C16H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-15(13-14-17)16(18)19/h15,17H,2-14H2,1H3,(H,18,19)
InChIKeyCBBPCTUZWQXJDG-UHFFFAOYSA-N
XLogP4.38
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-hydroxyethyl)octadecanoic acid
CID 19915552
2-(4-hydroxybutyl)octadecanoic acid
CID 88766543
2-(10-hydroxydecyl)icosanoic acid
CID 87534717
2-dodecyldotriacontanoic acid
CID 90853745
2-pentyldodecanoic acid
CID 18521426
2-undecylhexadecanoic acid
CID 139670823
2-hexylpentacosanoic acid
CID 158257677
2-nonylpentadecanoic acid
CID 139605044
2-heptadecylicosanoic acid
CID 57459073
2-nonyldodecanoic acid
CID 57283654
2-dodecyloctacosanoic acid
CID 90897371
2-dodecylhexadecanoic acid;2-dodecylicosanoic acid;2-dodecyloctadecanoic acid;2-hexadecyloctadecanoic acid;2-tetradecylhexadecanoic acid;2-tetradecyloctadecanoic acid
CID 173164625

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethyl)tetradecanoic acid?
The IUPAC name of 2-(2-hydroxyethyl)tetradecanoic acid (CID 54117326) is 2-(2-hydroxyethyl)tetradecanoic acid.
What is the SMILES notation for 2-(2-hydroxyethyl)tetradecanoic acid?
The canonical SMILES for 2-(2-hydroxyethyl)tetradecanoic acid is CCCCCCCCCCCCC(CCO)C(=O)O.
What is the InChIKey of 2-(2-hydroxyethyl)tetradecanoic acid?
The InChIKey is CBBPCTUZWQXJDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-15(13-14-17)16(18)19/h15,17H,2-14H2,1H3,(H,18,19).
What are the key properties of 2-(2-hydroxyethyl)tetradecanoic acid?
2-(2-hydroxyethyl)tetradecanoic acid has a molecular weight of 272.43 g/mol, XLogP of 4.38, 14 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethyl)tetradecanoic acid is sourced from PubChem (CID 54117326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).