(Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene

C20H40O4 — CID 166757933

IUPAC(Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene
SMILESCCCCCCCC/C(OCCCC)=C(\OCCCC)OCOC
InChIInChI=1S/C20H40O4/c1-5-8-11-12-13-14-15-19(22-16-9-6-2)20(24-18-21-4)23-17-10-7-3/h5-18H2,1-4H3/b20-19-
InChIKeyUVSKDGBMPYTSNH-VXPUYCOJSA-N
MW344.54 g/mol
LogP6.16
Rot. Bonds18

About (Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene

(Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene (PubChem CID 166757933) has the molecular formula C20H40O4 and a molecular weight of 344.54 g/mol. Its IUPAC name is (Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene.

Molecular Properties

Compound Name(Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene
PubChem CID166757933
Molecular FormulaC20H40O4
Molecular Weight344.54 g/mol
Exact Mass344.29
IUPAC Name(Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene
SMILESCCCCCCCC/C(OCCCC)=C(\OCCCC)OCOC
InChIInChI=1S/C20H40O4/c1-5-8-11-12-13-14-15-19(22-16-9-6-2)20(24-18-21-4)23-17-10-7-3/h5-18H2,1-4H3/b20-19-
InChIKeyUVSKDGBMPYTSNH-VXPUYCOJSA-N
XLogP6.16
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds18
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.54
LogP ≤ 56.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene 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

1,2-dibutoxy-1-(methoxymethoxy)oct-1-ene
CID 166758083
(Z)-1,2-dibutoxy-1-(methoxymethoxy)oct-1-ene
CID 166758082
1-(methoxymethoxy)-1,2-dipentoxyundec-1-ene
CID 166758186
1-(methoxymethoxy)-1,2-di(nonoxy)dodec-1-ene
CID 166757481
1-[1-(methoxymethoxy)-1-octoxyhex-1-en-2-yl]oxyoctane
CID 166758231
1-[1-decoxy-1-(methoxymethoxy)hex-1-en-2-yl]oxydecane
CID 166757652
1-(methoxymethoxy)-1,2-dipentoxypent-1-ene
CID 166757454
(Z)-1,2-diethoxy-1-(methoxymethoxy)undec-1-ene
CID 166757534
1-(heptoxymethoxy)-1,2-dipentoxyhept-1-ene
CID 166757816
1-(butoxymethoxy)-1,2-dipropoxyhept-1-ene
CID 166757268
(Z)-1,2-dimethoxy-1-(methoxymethoxy)tridec-1-ene
CID 166758033
1-[[(Z)-1,2-dibutoxypent-1-enoxy]methoxy]heptane
CID 166757505

Frequently Asked Questions

What is the IUPAC name of (Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene?
The IUPAC name of (Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene (CID 166757933) is (Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene.
What is the SMILES notation for (Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene?
The canonical SMILES for (Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene is CCCCCCCC/C(OCCCC)=C(\OCCCC)OCOC.
What is the InChIKey of (Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene?
The InChIKey is UVSKDGBMPYTSNH-VXPUYCOJSA-N. The full InChI is InChI=1S/C20H40O4/c1-5-8-11-12-13-14-15-19(22-16-9-6-2)20(24-18-21-4)23-17-10-7-3/h5-18H2,1-4H3/b20-19-.
What are the key properties of (Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene?
(Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene has a molecular weight of 344.54 g/mol, XLogP of 6.16, 18 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,2-dibutoxy-1-(methoxymethoxy)dec-1-ene is sourced from PubChem (CID 166757933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).