1,1-dimethoxynon-2-ene

C11H22O2 — CID 71435649

IUPAC1,1-dimethoxynon-2-ene
SMILESCCCCCCC=CC(OC)OC
InChIInChI=1S/C11H22O2/c1-4-5-6-7-8-9-10-11(12-2)13-3/h9-11H,4-8H2,1-3H3
InChIKeyVKWXFMOLPWWLDR-UHFFFAOYSA-N
MW186.29 g/mol
LogP3.13
Rot. Bonds8

About 1,1-dimethoxynon-2-ene

1,1-dimethoxynon-2-ene (PubChem CID 71435649) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 1,1-dimethoxynon-2-ene.

Molecular Properties

Compound Name1,1-dimethoxynon-2-ene
PubChem CID71435649
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name1,1-dimethoxynon-2-ene
SMILESCCCCCCC=CC(OC)OC
InChIInChI=1S/C11H22O2/c1-4-5-6-7-8-9-10-11(12-2)13-3/h9-11H,4-8H2,1-3H3
InChIKeyVKWXFMOLPWWLDR-UHFFFAOYSA-N
XLogP3.13
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(E)-1,1-diethoxydec-2-ene
CID 6437222
1,1-diethoxyundec-2-ene
CID 3018094
1-[1-decoxy-8-(8,8-didecoxy-1-methoxyoct-2-enoxy)-8-methoxyoct-6-enoxy]decane
CID 162350322
1-(18,18-diheptoxy-1-methoxyoctadec-2-enoxy)-18,18-diheptoxy-1-methoxyoctadec-2-ene
CID 163287779
1-methoxy-1-(1-methoxy-8,8-dioctoxyoct-2-enoxy)-8,8-dioctoxyoct-2-ene
CID 162350291
12,12-didecoxy-1-(12,12-didecoxy-1-methoxydodec-2-enoxy)-1-methoxydodec-2-ene
CID 162350514
(Z)-6-chloro-1,1-dimethoxyhex-2-ene
CID 146574511
9,9-dibutoxy-1-(9,9-dibutoxy-1-methoxynon-2-enoxy)-1-methoxynon-2-ene
CID 162350306
1-(7,7-dihexoxy-1-methoxyhept-2-enoxy)-7,7-dihexoxy-1-methoxyhept-2-ene
CID 162350477
(E)-1,1,1-trifluoro-2-methoxydec-3-ene
CID 101245473
1-(13,13-dimethoxy-1-pentoxytridec-2-enoxy)-13,13-dimethoxy-1-pentoxytridec-2-ene
CID 163287735
tetrakis[(E)-hept-1-enyl]phosphanium
CID 118306753

Frequently Asked Questions

What is the IUPAC name of 1,1-dimethoxynon-2-ene?
The IUPAC name of 1,1-dimethoxynon-2-ene (CID 71435649) is 1,1-dimethoxynon-2-ene.
What is the SMILES notation for 1,1-dimethoxynon-2-ene?
The canonical SMILES for 1,1-dimethoxynon-2-ene is CCCCCCC=CC(OC)OC.
What is the InChIKey of 1,1-dimethoxynon-2-ene?
The InChIKey is VKWXFMOLPWWLDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c1-4-5-6-7-8-9-10-11(12-2)13-3/h9-11H,4-8H2,1-3H3.
What are the key properties of 1,1-dimethoxynon-2-ene?
1,1-dimethoxynon-2-ene has a molecular weight of 186.29 g/mol, XLogP of 3.13, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethoxynon-2-ene is sourced from PubChem (CID 71435649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).