1-methoxy-2-methylhex-1-ene

C8H16O — CID 150215041

IUPAC1-methoxy-2-methylhex-1-ene
SMILESCCCCC(C)=COC
InChIInChI=1S/C8H16O/c1-4-5-6-8(2)7-9-3/h7H,4-6H2,1-3H3
InChIKeyFSHJMQXHLILBRO-UHFFFAOYSA-N
MW128.21 g/mol
LogP2.73
Rot. Bonds4

About 1-methoxy-2-methylhex-1-ene

1-methoxy-2-methylhex-1-ene (PubChem CID 150215041) has the molecular formula C8H16O and a molecular weight of 128.21 g/mol. Its IUPAC name is 1-methoxy-2-methylhex-1-ene.

Molecular Properties

Compound Name1-methoxy-2-methylhex-1-ene
PubChem CID150215041
Molecular FormulaC8H16O
Molecular Weight128.21 g/mol
Exact Mass128.12
IUPAC Name1-methoxy-2-methylhex-1-ene
SMILESCCCCC(C)=COC
InChIInChI=1S/C8H16O/c1-4-5-6-8(2)7-9-3/h7H,4-6H2,1-3H3
InChIKeyFSHJMQXHLILBRO-UHFFFAOYSA-N
XLogP2.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.21
LogP ≤ 52.73
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

(Methoxymethylene)cyclohexane
CID 12261950
(Methoxymethylene)cyclododecane
CID 12553326
Butoxymethylidenecyclohexane
CID 12794829
(Methoxymethylidene)cycloheptane
CID 13163955
Heptenyl ether
CID 54375697
Ethyl-propyl-vinyl ether
CID 129736118
6-(Methoxymethylene)undecane
CID 134895818
3-(Methoxymethylene)pentane
CID 22234822
(E)-1-methoxyhept-1-ene
CID 11126280
(Ethoxymethylene)cyclohexane
CID 12361524
(1Z)-1-heptenyl methyl ether
CID 21677643
2-Methyl-1-(2-methyldec-1-enoxy)dec-1-ene
CID 90792980

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-methylhex-1-ene?
The IUPAC name of 1-methoxy-2-methylhex-1-ene (CID 150215041) is 1-methoxy-2-methylhex-1-ene.
What is the SMILES notation for 1-methoxy-2-methylhex-1-ene?
The canonical SMILES for 1-methoxy-2-methylhex-1-ene is CCCCC(C)=COC.
What is the InChIKey of 1-methoxy-2-methylhex-1-ene?
The InChIKey is FSHJMQXHLILBRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O/c1-4-5-6-8(2)7-9-3/h7H,4-6H2,1-3H3.
What are the key properties of 1-methoxy-2-methylhex-1-ene?
1-methoxy-2-methylhex-1-ene has a molecular weight of 128.21 g/mol, XLogP of 2.73, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-methylhex-1-ene is sourced from PubChem (CID 150215041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).