(10E)-trideca-1,10-dien-2-ol

C13H24O — CID 87688882

IUPAC(10E)-trideca-1,10-dien-2-ol
SMILESC=C(O)CCCCCCC/C=C/CC
InChIInChI=1S/C13H24O/c1-3-4-5-6-7-8-9-10-11-12-13(2)14/h4-5,14H,2-3,6-12H2,1H3/b5-4+
InChIKeyMACLAFYLZKYZOL-SNAWJCMRSA-N
MW196.33 g/mol
LogP4.76
Rot. Bonds9

About (10E)-trideca-1,10-dien-2-ol

(10E)-trideca-1,10-dien-2-ol (PubChem CID 87688882) has the molecular formula C13H24O and a molecular weight of 196.33 g/mol. Its IUPAC name is (10E)-trideca-1,10-dien-2-ol.

Molecular Properties

Compound Name(10E)-trideca-1,10-dien-2-ol
PubChem CID87688882
Molecular FormulaC13H24O
Molecular Weight196.33 g/mol
Exact Mass196.18
IUPAC Name(10E)-trideca-1,10-dien-2-ol
SMILESC=C(O)CCCCCCC/C=C/CC
InChIInChI=1S/C13H24O/c1-3-4-5-6-7-8-9-10-11-12-13(2)14/h4-5,14H,2-3,6-12H2,1H3/b5-4+
InChIKeyMACLAFYLZKYZOL-SNAWJCMRSA-N
XLogP4.76
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.33
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(3E,16E)-nonadeca-3,16-diene
CID 157471321
nona-1,7-dien-2-ol
CID 172729481
icosa-4,11,17-trienoic acid
CID 159256769
octadec-15-enamide
CID 54276805
henicosa-15,18-dienoic acid
CID 169277369
icosa-8,14,17-trienoic acid
CID 54189424
octacosa-10,13,16,19,22,25-hexaenoic acid
CID 75955160
(12Z,15Z)-octadeca-12,15-dienoic acid
CID 5312453
(10Z,13Z,16Z,19Z,22Z,25Z)-octacosa-10,13,16,19,22,25-hexaenoic acid
CID 52921814
(19Z,22Z,25Z,28Z,31Z)-tetratriaconta-19,22,25,28,31-pentaenoic acid
CID 14753668
(8Z,11Z,14Z,17Z,20Z,23Z,26Z,29Z)-dotriaconta-8,11,14,17,20,23,26,29-octaenoic acid
CID 165203838
(9Z,12Z,15Z,18Z)-tetracosa-9,12,15,18,21-pentaenoic acid
CID 87220855

Frequently Asked Questions

What is the IUPAC name of (10E)-trideca-1,10-dien-2-ol?
The IUPAC name of (10E)-trideca-1,10-dien-2-ol (CID 87688882) is (10E)-trideca-1,10-dien-2-ol.
What is the SMILES notation for (10E)-trideca-1,10-dien-2-ol?
The canonical SMILES for (10E)-trideca-1,10-dien-2-ol is C=C(O)CCCCCCC/C=C/CC.
What is the InChIKey of (10E)-trideca-1,10-dien-2-ol?
The InChIKey is MACLAFYLZKYZOL-SNAWJCMRSA-N. The full InChI is InChI=1S/C13H24O/c1-3-4-5-6-7-8-9-10-11-12-13(2)14/h4-5,14H,2-3,6-12H2,1H3/b5-4+.
What are the key properties of (10E)-trideca-1,10-dien-2-ol?
(10E)-trideca-1,10-dien-2-ol has a molecular weight of 196.33 g/mol, XLogP of 4.76, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (10E)-trideca-1,10-dien-2-ol is sourced from PubChem (CID 87688882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).