(E)-10-hydroxydec-2-enoic acid

C10H18O3 — CID 5312738

IUPAC(E)-10-hydroxydec-2-enoic acid
SMILESO=C(O)/C=C/CCCCCCCO
InChIInChI=1S/C10H18O3/c11-9-7-5-3-1-2-4-6-8-10(12)13/h6,8,11H,1-5,7,9H2,(H,12,13)/b8-6+
InChIKeyQHBZHVUGQROELI-SOFGYWHQSA-N
MW186.25 g/mol
LogP1.96
Rot. Bonds8

About (E)-10-hydroxydec-2-enoic acid

(E)-10-hydroxydec-2-enoic acid (PubChem CID 5312738) has the molecular formula C10H18O3 and a molecular weight of 186.25 g/mol. Its IUPAC name is (E)-10-hydroxydec-2-enoic acid.

Molecular Properties

Compound Name(E)-10-hydroxydec-2-enoic acid
PubChem CID5312738
Molecular FormulaC10H18O3
Molecular Weight186.25 g/mol
Exact Mass186.13
IUPAC Name(E)-10-hydroxydec-2-enoic acid
SMILESO=C(O)/C=C/CCCCCCCO
InChIInChI=1S/C10H18O3/c11-9-7-5-3-1-2-4-6-8-10(12)13/h6,8,11H,1-5,7,9H2,(H,12,13)/b8-6+
InChIKeyQHBZHVUGQROELI-SOFGYWHQSA-N
XLogP1.96
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

20-hydroxyicosa-2,5-dienoic acid
CID 91232457
hexan-1-ol;non-2-enedioic acid
CID 174499923
(E)-but-2-enedioic acid;decane-1,10-diol
CID 175360158
(E)-10-(10-hydroxydecanoyloxy)dec-2-enoic acid
CID 11530520
(Z)-undec-2-enedioic acid
CID 59435158
undec-2-enoic acid
CID 519180
14-bromotetradec-2-enoic acid
CID 54270933
octadec-2-enoic acid;hydrochloride
CID 175477245
(33Z)-octatetraconta-2,33-dienedioic acid
CID 87703838
(E)-14-aminotetradec-2-enoic acid;hydrochloride
CID 25028644
icosa-2,12-dienoic acid
CID 174301675
icosa-2,11-dienoic acid
CID 54537818

Frequently Asked Questions

What is the IUPAC name of (E)-10-hydroxydec-2-enoic acid?
The IUPAC name of (E)-10-hydroxydec-2-enoic acid (CID 5312738) is (E)-10-hydroxydec-2-enoic acid.
What is the SMILES notation for (E)-10-hydroxydec-2-enoic acid?
The canonical SMILES for (E)-10-hydroxydec-2-enoic acid is O=C(O)/C=C/CCCCCCCO.
What is the InChIKey of (E)-10-hydroxydec-2-enoic acid?
The InChIKey is QHBZHVUGQROELI-SOFGYWHQSA-N. The full InChI is InChI=1S/C10H18O3/c11-9-7-5-3-1-2-4-6-8-10(12)13/h6,8,11H,1-5,7,9H2,(H,12,13)/b8-6+.
What are the key properties of (E)-10-hydroxydec-2-enoic acid?
(E)-10-hydroxydec-2-enoic acid has a molecular weight of 186.25 g/mol, XLogP of 1.96, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-10-hydroxydec-2-enoic acid is sourced from PubChem (CID 5312738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).