(Z)-1-ethoxy-4-methylhex-1-ene

C9H18O — CID 11400836

IUPAC(Z)-1-ethoxy-4-methylhex-1-ene
SMILESCCO/C=C\CC(C)CC
InChIInChI=1S/C9H18O/c1-4-9(3)7-6-8-10-5-2/h6,8-9H,4-5,7H2,1-3H3/b8-6-
InChIKeyPQWOEHIPTDSSHJ-VURMDHGXSA-N
MW142.24 g/mol
LogP2.97
Rot. Bonds5

About (Z)-1-ethoxy-4-methylhex-1-ene

(Z)-1-ethoxy-4-methylhex-1-ene (PubChem CID 11400836) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is (Z)-1-ethoxy-4-methylhex-1-ene.

Molecular Properties

Compound Name(Z)-1-ethoxy-4-methylhex-1-ene
PubChem CID11400836
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name(Z)-1-ethoxy-4-methylhex-1-ene
SMILESCCO/C=C\CC(C)CC
InChIInChI=1S/C9H18O/c1-4-9(3)7-6-8-10-5-2/h6,8-9H,4-5,7H2,1-3H3/b8-6-
InChIKeyPQWOEHIPTDSSHJ-VURMDHGXSA-N
XLogP2.97
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-1-ethoxy-4-methyltridec-1-ene
CID 102052028
(E)-5-methylhept-2-ene
CID 5364849
diethyl 2-[(E)-3-ethoxyprop-2-enyl]propanedioate
CID 13218045
3-ethoxyprop-2-enylsilane
CID 150379545
(Z)-1-ethoxypent-1-ene
CID 12512190
(3E)-1,4-diethoxybuta-1,3-diene
CID 173199605
(E)-3,8,10,10-tetramethylundec-5-ene
CID 155643591
1-ethoxy-3-(3-ethoxyprop-2-enyldisulfanyl)prop-1-ene
CID 134208767
4-ethoxy-1-phenylbut-3-en-1-ol
CID 4552736
(Z)-4-ethoxy-1-phenylbut-3-en-1-ol
CID 44889759
2,6-dimethyloct-3-en-2-ol
CID 3019835
(E)-2,6-dimethyloct-3-en-2-ol
CID 6365952

Frequently Asked Questions

What is the IUPAC name of (Z)-1-ethoxy-4-methylhex-1-ene?
The IUPAC name of (Z)-1-ethoxy-4-methylhex-1-ene (CID 11400836) is (Z)-1-ethoxy-4-methylhex-1-ene.
What is the SMILES notation for (Z)-1-ethoxy-4-methylhex-1-ene?
The canonical SMILES for (Z)-1-ethoxy-4-methylhex-1-ene is CCO/C=C\CC(C)CC.
What is the InChIKey of (Z)-1-ethoxy-4-methylhex-1-ene?
The InChIKey is PQWOEHIPTDSSHJ-VURMDHGXSA-N. The full InChI is InChI=1S/C9H18O/c1-4-9(3)7-6-8-10-5-2/h6,8-9H,4-5,7H2,1-3H3/b8-6-.
What are the key properties of (Z)-1-ethoxy-4-methylhex-1-ene?
(Z)-1-ethoxy-4-methylhex-1-ene has a molecular weight of 142.24 g/mol, XLogP of 2.97, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-ethoxy-4-methylhex-1-ene is sourced from PubChem (CID 11400836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).