1-Decene, 1-ethoxy-

C12H24O — CID 53422433

IUPAC1-ethoxydec-1-ene
SMILESCCCCCCCCC=COCC
InChIInChI=1S/C12H24O/c1-3-5-6-7-8-9-10-11-12-13-4-2/h11-12H,3-10H2,1-2H3
InChIKeyOGHVFBHUBBKMAK-UHFFFAOYSA-N
MW184.32 g/mol
LogP5.10
Rot. Bonds9

About 1-Decene, 1-ethoxy-

1-Decene, 1-ethoxy- (PubChem CID 53422433) has the molecular formula C12H24O and a molecular weight of 184.32 g/mol. Its IUPAC name is 1-ethoxydec-1-ene.

Molecular Properties

Compound Name1-Decene, 1-ethoxy-
PubChem CID53422433
Molecular FormulaC12H24O
Molecular Weight184.32 g/mol
Exact Mass184.18
IUPAC Name1-ethoxydec-1-ene
SMILESCCCCCCCCC=COCC
InChIInChI=1S/C12H24O/c1-3-5-6-7-8-9-10-11-12-13-4-2/h11-12H,3-10H2,1-2H3
InChIKeyOGHVFBHUBBKMAK-UHFFFAOYSA-N
XLogP5.10
TPSA9.20 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms13
Complexity108

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500184.32
LogP ≤ 55.10
H-Bond Donors ≤ 50
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'}

Analyze 1-Decene, 1-ethoxy- 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

1-Methoxydecene
CID 6365701
Dodecenol
CID 6443191
1-Methoxydec-1-ene
CID 3018221
Dodec-1-EN-1-OL
CID 187947
1-Ethoxy-1-hexene
CID 10877141
Tridecenol
CID 20397979
(E)-1-ethoxydec-1-ene
CID 21972057
Undecenyl alcohol
CID 44135745
Dec-1-en-1-ol
CID 53438524
alpha-Octadec-1-enyl ether
CID 54273952
Hexadec-1-enyl ether
CID 57140599
1-Tetradecenyl alcohol
CID 71379595

Frequently Asked Questions

What is the IUPAC name of 1-Decene, 1-ethoxy-?
The IUPAC name of 1-Decene, 1-ethoxy- (CID 53422433) is 1-ethoxydec-1-ene.
What is the SMILES notation for 1-Decene, 1-ethoxy-?
The canonical SMILES for 1-Decene, 1-ethoxy- is CCCCCCCCC=COCC.
What is the InChIKey of 1-Decene, 1-ethoxy-?
The InChIKey is OGHVFBHUBBKMAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O/c1-3-5-6-7-8-9-10-11-12-13-4-2/h11-12H,3-10H2,1-2H3.
What are the key properties of 1-Decene, 1-ethoxy-?
1-Decene, 1-ethoxy- has a molecular weight of 184.32 g/mol, XLogP of 5.10, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-Decene, 1-ethoxy- is sourced from PubChem (CID 53422433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).