deca-2,3-diene

C10H18 — CID 10931500

IUPACdeca-2,3-diene
SMILESCC=C=CCCCCCC
InChIInChI=1S/C10H18/c1-3-5-7-9-10-8-6-4-2/h3,7H,4,6,8-10H2,1-2H3
InChIKeyZMIIRIKUCQZRMI-UHFFFAOYSA-N
MW138.25 g/mol
LogP3.69
Rot. Bonds5

About deca-2,3-diene

deca-2,3-diene (PubChem CID 10931500) has the molecular formula C10H18 and a molecular weight of 138.25 g/mol. Its IUPAC name is deca-2,3-diene.

Molecular Properties

Compound Namedeca-2,3-diene
PubChem CID10931500
Molecular FormulaC10H18
Molecular Weight138.25 g/mol
Exact Mass138.14
IUPAC Namedeca-2,3-diene
SMILESCC=C=CCCCCCC
InChIInChI=1S/C10H18/c1-3-5-7-9-10-8-6-4-2/h3,7H,4,6,8-10H2,1-2H3
InChIKeyZMIIRIKUCQZRMI-UHFFFAOYSA-N
XLogP3.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.25
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of deca-2,3-diene?
The IUPAC name of deca-2,3-diene (CID 10931500) is deca-2,3-diene.
What is the SMILES notation for deca-2,3-diene?
The canonical SMILES for deca-2,3-diene is CC=C=CCCCCCC.
What is the InChIKey of deca-2,3-diene?
The InChIKey is ZMIIRIKUCQZRMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18/c1-3-5-7-9-10-8-6-4-2/h3,7H,4,6,8-10H2,1-2H3.
What are the key properties of deca-2,3-diene?
deca-2,3-diene has a molecular weight of 138.25 g/mol, XLogP of 3.69, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for deca-2,3-diene is sourced from PubChem (CID 10931500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).