(5S)-5-hydroxydecanoic acid

C10H20O3 — CID 6604110

IUPAC(5S)-5-hydroxydecanoic acid
SMILESCCCCC[C@H](O)CCCC(=O)O
InChIInChI=1S/C10H20O3/c1-2-3-4-6-9(11)7-5-8-10(12)13/h9,11H,2-8H2,1H3,(H,12,13)/t9-/m0/s1
InChIKeyLMHJFKYQYDSOQO-VIFPVBQESA-N
MW188.27 g/mol
LogP2.18
Rot. Bonds8

About (5S)-5-hydroxydecanoic acid

(5S)-5-hydroxydecanoic acid (PubChem CID 6604110) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is (5S)-5-hydroxydecanoic acid.

Molecular Properties

Compound Name(5S)-5-hydroxydecanoic acid
PubChem CID6604110
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name(5S)-5-hydroxydecanoic acid
SMILESCCCCC[C@H](O)CCCC(=O)O
InChIInChI=1S/C10H20O3/c1-2-3-4-6-9(11)7-5-8-10(12)13/h9,11H,2-8H2,1H3,(H,12,13)/t9-/m0/s1
InChIKeyLMHJFKYQYDSOQO-VIFPVBQESA-N
XLogP2.18
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.18
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

5-hydroxydecanoic acid
CID 161390265
5-hydroxyhexadecanoic acid
CID 5312761
12-hydroxyheptadecanoic acid
CID 15110021
9-hydroxytriacontanoic acid
CID 169277258
14-hydroxypentacosanoic acid
CID 169276940
21-hydroxyheptacosanoic acid
CID 169277079
(9R)-9-hydroxytetradecanoic acid
CID 22822871
(8S)-8-hydroxytetradecanoic acid
CID 123133458
hexadecan-7-ol;octadecanoic acid
CID 174589795
9-hydroxyheptadecanoic acid
CID 86012010
11-hydroxydocosanoic acid
CID 86066603
pentanoic acid;tetracosan-11-ol
CID 175196801

Frequently Asked Questions

What is the IUPAC name of (5S)-5-hydroxydecanoic acid?
The IUPAC name of (5S)-5-hydroxydecanoic acid (CID 6604110) is (5S)-5-hydroxydecanoic acid.
What is the SMILES notation for (5S)-5-hydroxydecanoic acid?
The canonical SMILES for (5S)-5-hydroxydecanoic acid is CCCCC[C@H](O)CCCC(=O)O.
What is the InChIKey of (5S)-5-hydroxydecanoic acid?
The InChIKey is LMHJFKYQYDSOQO-VIFPVBQESA-N. The full InChI is InChI=1S/C10H20O3/c1-2-3-4-6-9(11)7-5-8-10(12)13/h9,11H,2-8H2,1H3,(H,12,13)/t9-/m0/s1.
What are the key properties of (5S)-5-hydroxydecanoic acid?
(5S)-5-hydroxydecanoic acid has a molecular weight of 188.27 g/mol, XLogP of 2.18, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-hydroxydecanoic acid is sourced from PubChem (CID 6604110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).