(4S)-4-(methoxymethoxy)non-1-ene

C11H22O2 — CID 134836991

IUPAC(4S)-4-(methoxymethoxy)non-1-ene
SMILESC=CC[C@H](CCCCC)OCOC
InChIInChI=1S/C11H22O2/c1-4-6-7-9-11(8-5-2)13-10-12-3/h5,11H,2,4,6-10H2,1,3H3/t11-/m1/s1
InChIKeyNPJVOFXFEBEZDY-LLVKDONJSA-N
MW186.29 g/mol
LogP3.13
Rot. Bonds9

About (4S)-4-(methoxymethoxy)non-1-ene

(4S)-4-(methoxymethoxy)non-1-ene (PubChem CID 134836991) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is (4S)-4-(methoxymethoxy)non-1-ene.

Molecular Properties

Compound Name(4S)-4-(methoxymethoxy)non-1-ene
PubChem CID134836991
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name(4S)-4-(methoxymethoxy)non-1-ene
SMILESC=CC[C@H](CCCCC)OCOC
InChIInChI=1S/C11H22O2/c1-4-6-7-9-11(8-5-2)13-10-12-3/h5,11H,2,4,6-10H2,1,3H3/t11-/m1/s1
InChIKeyNPJVOFXFEBEZDY-LLVKDONJSA-N
XLogP3.13
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
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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Frequently Asked Questions

What is the IUPAC name of (4S)-4-(methoxymethoxy)non-1-ene?
The IUPAC name of (4S)-4-(methoxymethoxy)non-1-ene (CID 134836991) is (4S)-4-(methoxymethoxy)non-1-ene.
What is the SMILES notation for (4S)-4-(methoxymethoxy)non-1-ene?
The canonical SMILES for (4S)-4-(methoxymethoxy)non-1-ene is C=CC[C@H](CCCCC)OCOC.
What is the InChIKey of (4S)-4-(methoxymethoxy)non-1-ene?
The InChIKey is NPJVOFXFEBEZDY-LLVKDONJSA-N. The full InChI is InChI=1S/C11H22O2/c1-4-6-7-9-11(8-5-2)13-10-12-3/h5,11H,2,4,6-10H2,1,3H3/t11-/m1/s1.
What are the key properties of (4S)-4-(methoxymethoxy)non-1-ene?
(4S)-4-(methoxymethoxy)non-1-ene has a molecular weight of 186.29 g/mol, XLogP of 3.13, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-(methoxymethoxy)non-1-ene is sourced from PubChem (CID 134836991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).