(E)-5-methoxy-2-methylhex-4-en-1-ol

C8H16O2 — CID 142061120

IUPAC(E)-5-methoxy-2-methylhex-4-en-1-ol
SMILESCO/C(C)=C/CC(C)CO
InChIInChI=1S/C8H16O2/c1-7(6-9)4-5-8(2)10-3/h5,7,9H,4,6H2,1-3H3/b8-5+
InChIKeyKLWRCNQUGHMUAD-VMPITWQZSA-N
MW144.21 g/mol
LogP1.56
Rot. Bonds4

About (E)-5-methoxy-2-methylhex-4-en-1-ol

(E)-5-methoxy-2-methylhex-4-en-1-ol (PubChem CID 142061120) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is (E)-5-methoxy-2-methylhex-4-en-1-ol.

Molecular Properties

Compound Name(E)-5-methoxy-2-methylhex-4-en-1-ol
PubChem CID142061120
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name(E)-5-methoxy-2-methylhex-4-en-1-ol
SMILESCO/C(C)=C/CC(C)CO
InChIInChI=1S/C8H16O2/c1-7(6-9)4-5-8(2)10-3/h5,7,9H,4,6H2,1-3H3/b8-5+
InChIKeyKLWRCNQUGHMUAD-VMPITWQZSA-N
XLogP1.56
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-5-ethyl-2-methoxyhept-2-ene
CID 87922233
(4E)-2,6-dimethylhepta-4,6-dien-1-ol
CID 130146963
(Z,2R,7S)-2-methyloct-4-ene-1,7-diol
CID 102067168
[(Z)-3-methoxybut-2-enyl] acetate
CID 135086169
(2E)-2-methoxy-6-methylhepta-2,5-diene
CID 143367783
methanol;(2S)-2-methylpent-4-en-1-ol
CID 143099829
5-methoxy-4-methylhex-3-en-1-ol
CID 91271839
(Z)-5-methoxyhex-4-en-2-one
CID 87291047
ethane;2-methylpropane-1,3-diol
CID 87127502
(Z)-2-methoxyhept-2-ene
CID 21160203
methyl 4-methoxypent-3-enoate
CID 131857194
2-methyl-3-(propan-2-ylamino)propan-1-ol
CID 20806708

Frequently Asked Questions

What is the IUPAC name of (E)-5-methoxy-2-methylhex-4-en-1-ol?
The IUPAC name of (E)-5-methoxy-2-methylhex-4-en-1-ol (CID 142061120) is (E)-5-methoxy-2-methylhex-4-en-1-ol.
What is the SMILES notation for (E)-5-methoxy-2-methylhex-4-en-1-ol?
The canonical SMILES for (E)-5-methoxy-2-methylhex-4-en-1-ol is CO/C(C)=C/CC(C)CO.
What is the InChIKey of (E)-5-methoxy-2-methylhex-4-en-1-ol?
The InChIKey is KLWRCNQUGHMUAD-VMPITWQZSA-N. The full InChI is InChI=1S/C8H16O2/c1-7(6-9)4-5-8(2)10-3/h5,7,9H,4,6H2,1-3H3/b8-5+.
What are the key properties of (E)-5-methoxy-2-methylhex-4-en-1-ol?
(E)-5-methoxy-2-methylhex-4-en-1-ol has a molecular weight of 144.21 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-methoxy-2-methylhex-4-en-1-ol is sourced from PubChem (CID 142061120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).