4-ethenoxydec-1-ene

C12H22O — CID 101377741

IUPAC4-ethenoxydec-1-ene
SMILESC=CCC(CCCCCC)OC=C
InChIInChI=1S/C12H22O/c1-4-7-8-9-11-12(10-5-2)13-6-3/h5-6,12H,2-4,7-11H2,1H3
InChIKeyHBJZFDKSYHOISB-UHFFFAOYSA-N
MW182.31 g/mol
LogP4.06
Rot. Bonds9

About 4-ethenoxydec-1-ene

4-ethenoxydec-1-ene (PubChem CID 101377741) has the molecular formula C12H22O and a molecular weight of 182.31 g/mol. Its IUPAC name is 4-ethenoxydec-1-ene.

Molecular Properties

Compound Name4-ethenoxydec-1-ene
PubChem CID101377741
Molecular FormulaC12H22O
Molecular Weight182.31 g/mol
Exact Mass182.17
IUPAC Name4-ethenoxydec-1-ene
SMILESC=CCC(CCCCCC)OC=C
InChIInChI=1S/C12H22O/c1-4-7-8-9-11-12(10-5-2)13-6-3/h5-6,12H,2-4,7-11H2,1H3
InChIKeyHBJZFDKSYHOISB-UHFFFAOYSA-N
XLogP4.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 54.06
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(7-Octenyl)oxirane
CID 543758
1-Decene, 10-methoxy-
CID 3085890
(R)-(+)-1,2-Epoxy-9-decene
CID 7018005
2-Dodec-11-enyloxirane
CID 5743593
1-Tridecen-4-ol
CID 10397999
4-Hydroxytetradec-1-ene
CID 11009268
1-Dodecen-4-ol
CID 11745312
(S)-1-Undecen-4-ol
CID 11378750
1-Nonen-3-ol, methyl ether
CID 12563924
Undec-1-en-4-ol
CID 10103696
(R)-1-pentadecen-4-ol
CID 10105124
1-Decen-4-ol
CID 11084129

Frequently Asked Questions

What is the IUPAC name of 4-ethenoxydec-1-ene?
The IUPAC name of 4-ethenoxydec-1-ene (CID 101377741) is 4-ethenoxydec-1-ene.
What is the SMILES notation for 4-ethenoxydec-1-ene?
The canonical SMILES for 4-ethenoxydec-1-ene is C=CCC(CCCCCC)OC=C.
What is the InChIKey of 4-ethenoxydec-1-ene?
The InChIKey is HBJZFDKSYHOISB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O/c1-4-7-8-9-11-12(10-5-2)13-6-3/h5-6,12H,2-4,7-11H2,1H3.
What are the key properties of 4-ethenoxydec-1-ene?
4-ethenoxydec-1-ene has a molecular weight of 182.31 g/mol, XLogP of 4.06, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenoxydec-1-ene is sourced from PubChem (CID 101377741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).