(E)-dec-4-ene-1,2-diol

C10H20O2 — CID 13288576

IUPAC(E)-dec-4-ene-1,2-diol
SMILESCCCCC/C=C/CC(O)CO
InChIInChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-10(12)9-11/h6-7,10-12H,2-5,8-9H2,1H3/b7-6+
InChIKeyWBMVOLPFVJEVDJ-VOTSOKGWSA-N
MW172.27 g/mol
LogP1.87
Rot. Bonds7

About (E)-dec-4-ene-1,2-diol

(E)-dec-4-ene-1,2-diol (PubChem CID 13288576) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is (E)-dec-4-ene-1,2-diol.

Molecular Properties

Compound Name(E)-dec-4-ene-1,2-diol
PubChem CID13288576
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name(E)-dec-4-ene-1,2-diol
SMILESCCCCC/C=C/CC(O)CO
InChIInChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-10(12)9-11/h6-7,10-12H,2-5,8-9H2,1H3/b7-6+
InChIKeyWBMVOLPFVJEVDJ-VOTSOKGWSA-N
XLogP1.87
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (E)-dec-4-ene-1,2-diol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E,2S,4R)-nonadec-6-ene-1,2,4-triol
CID 56590714
(2R,4R)-nonadec-6-ene-1,2,4-triol
CID 162937145
(E)-nonadec-5-ene-1,2-diol
CID 142781627
octadec-9-ene-1,2-diol
CID 139720566
(E)-heptadec-7-en-5-ol
CID 122442571
(Z)-octadec-10-en-8-ol
CID 173051806
(Z)-pentadec-8-en-6-ol
CID 10398809
(E,10S)-henicos-7-en-10-ol
CID 14607531
1-aminotridec-4-en-2-ol
CID 73116703
(Z)-tridec-8-en-6-ol
CID 170849340
(Z,3R)-3-hydroxydodec-5-enal
CID 173358964
(E)-dec-5-en-3-ol
CID 21493231

Frequently Asked Questions

What is the IUPAC name of (E)-dec-4-ene-1,2-diol?
The IUPAC name of (E)-dec-4-ene-1,2-diol (CID 13288576) is (E)-dec-4-ene-1,2-diol.
What is the SMILES notation for (E)-dec-4-ene-1,2-diol?
The canonical SMILES for (E)-dec-4-ene-1,2-diol is CCCCC/C=C/CC(O)CO.
What is the InChIKey of (E)-dec-4-ene-1,2-diol?
The InChIKey is WBMVOLPFVJEVDJ-VOTSOKGWSA-N. The full InChI is InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-10(12)9-11/h6-7,10-12H,2-5,8-9H2,1H3/b7-6+.
What are the key properties of (E)-dec-4-ene-1,2-diol?
(E)-dec-4-ene-1,2-diol has a molecular weight of 172.27 g/mol, XLogP of 1.87, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-dec-4-ene-1,2-diol is sourced from PubChem (CID 13288576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).