(E)-3,4-dimethoxypent-2-ene

C7H14O2 — CID 143241660

IUPAC(E)-3,4-dimethoxypent-2-ene
SMILESC/C=C(/OC)C(C)OC
InChIInChI=1S/C7H14O2/c1-5-7(9-4)6(2)8-3/h5-6H,1-4H3/b7-5+
InChIKeyPSOKJHYCFNZLBT-FNORWQNLSA-N
MW130.19 g/mol
LogP1.57
Rot. Bonds3

About (E)-3,4-dimethoxypent-2-ene

(E)-3,4-dimethoxypent-2-ene (PubChem CID 143241660) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is (E)-3,4-dimethoxypent-2-ene.

Molecular Properties

Compound Name(E)-3,4-dimethoxypent-2-ene
PubChem CID143241660
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Name(E)-3,4-dimethoxypent-2-ene
SMILESC/C=C(/OC)C(C)OC
InChIInChI=1S/C7H14O2/c1-5-7(9-4)6(2)8-3/h5-6H,1-4H3/b7-5+
InChIKeyPSOKJHYCFNZLBT-FNORWQNLSA-N
XLogP1.57
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,3,5-Trimethoxycyclohexa-1,4-diene
CID 91534566
5-(Methoxymethyl)-2,3-dihydrofuran
CID 67156624
5-(1-Methoxyethyl)-2,3-dihydrofuran
CID 129777446
(E,4S)-4-ethenoxypent-2-ene
CID 134839398
(Z,4S)-4-ethenoxypent-2-ene
CID 134859138
[(Z)-4-methoxypent-2-en-2-yl] hypofluorite
CID 145684185
(Z)-1,2,4-trimethoxybut-2-ene
CID 5356164
(E)-1,4-dimethoxypent-2-ene
CID 13244906
6-(methoxymethyl)-3,4-dihydro-2H-pyran
CID 12072135
5-methoxy-3,6-dihydro-2H-pyran
CID 20567886
(E)-1,4,5-trimethoxypent-2-ene
CID 20648302
2-(Ethenoxymethyl)-2,5-dihydrofuran
CID 21921990

Frequently Asked Questions

What is the IUPAC name of (E)-3,4-dimethoxypent-2-ene?
The IUPAC name of (E)-3,4-dimethoxypent-2-ene (CID 143241660) is (E)-3,4-dimethoxypent-2-ene.
What is the SMILES notation for (E)-3,4-dimethoxypent-2-ene?
The canonical SMILES for (E)-3,4-dimethoxypent-2-ene is C/C=C(/OC)C(C)OC.
What is the InChIKey of (E)-3,4-dimethoxypent-2-ene?
The InChIKey is PSOKJHYCFNZLBT-FNORWQNLSA-N. The full InChI is InChI=1S/C7H14O2/c1-5-7(9-4)6(2)8-3/h5-6H,1-4H3/b7-5+.
What are the key properties of (E)-3,4-dimethoxypent-2-ene?
(E)-3,4-dimethoxypent-2-ene has a molecular weight of 130.19 g/mol, XLogP of 1.57, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3,4-dimethoxypent-2-ene is sourced from PubChem (CID 143241660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).