12-(methoxymethoxy)dodeca-1,2-diene

C14H26O2 — CID 10987959

IUPAC12-(methoxymethoxy)dodeca-1,2-diene
SMILESC=C=CCCCCCCCCCOCOC
InChIInChI=1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14-15-2/h4H,1,5-14H2,2H3
InChIKeyHWSVDPWJGSZPGH-UHFFFAOYSA-N
MW226.36 g/mol
LogP4.07
Rot. Bonds12

About 12-(methoxymethoxy)dodeca-1,2-diene

12-(methoxymethoxy)dodeca-1,2-diene (PubChem CID 10987959) has the molecular formula C14H26O2 and a molecular weight of 226.36 g/mol. Its IUPAC name is 12-(methoxymethoxy)dodeca-1,2-diene.

Molecular Properties

Compound Name12-(methoxymethoxy)dodeca-1,2-diene
PubChem CID10987959
Molecular FormulaC14H26O2
Molecular Weight226.36 g/mol
Exact Mass226.19
IUPAC Name12-(methoxymethoxy)dodeca-1,2-diene
SMILESC=C=CCCCCCCCCCOCOC
InChIInChI=1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14-15-2/h4H,1,5-14H2,2H3
InChIKeyHWSVDPWJGSZPGH-UHFFFAOYSA-N
XLogP4.07
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 54.07
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'}

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Related Compounds

9-Decenal diethyl acetal
CID 86584457
1-Undecene, 11,11-dimethoxy-
CID 103375
9,9,9-Trimethoxynon-1-ene
CID 141295340
1-Undecene, 11,11-diethoxy-
CID 568604
13-(Methoxymethoxy)trideca-1,2-diene
CID 85687860
(4S)-4-(methoxymethoxy)non-1-ene
CID 134836991
12,12-Dimethoxydodec-1-ene
CID 135085656
Carbonic acid, butyl undec-10-enyl ester
CID 6420629
Carbonic acid, propyl undec-10-enyl ester
CID 6420632
Carbonic acid, ethyl undec-10-enyl ester
CID 6420634
4-(Methoxymethoxy)non-1-ene
CID 14592865
5,5-Dideuterio-7-(methoxymethoxy)undec-1-ene
CID 15262319

Frequently Asked Questions

What is the IUPAC name of 12-(methoxymethoxy)dodeca-1,2-diene?
The IUPAC name of 12-(methoxymethoxy)dodeca-1,2-diene (CID 10987959) is 12-(methoxymethoxy)dodeca-1,2-diene.
What is the SMILES notation for 12-(methoxymethoxy)dodeca-1,2-diene?
The canonical SMILES for 12-(methoxymethoxy)dodeca-1,2-diene is C=C=CCCCCCCCCCOCOC.
What is the InChIKey of 12-(methoxymethoxy)dodeca-1,2-diene?
The InChIKey is HWSVDPWJGSZPGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14-15-2/h4H,1,5-14H2,2H3.
What are the key properties of 12-(methoxymethoxy)dodeca-1,2-diene?
12-(methoxymethoxy)dodeca-1,2-diene has a molecular weight of 226.36 g/mol, XLogP of 4.07, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 12-(methoxymethoxy)dodeca-1,2-diene is sourced from PubChem (CID 10987959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).