2-ethenyl-6-methoxy-2-methylhexan-1-ol

C10H20O2 — CID 102641801

IUPAC2-ethenyl-6-methoxy-2-methylhexan-1-ol
SMILESC=CC(C)(CO)CCCCOC
InChIInChI=1S/C10H20O2/c1-4-10(2,9-11)7-5-6-8-12-3/h4,11H,1,5-9H2,2-3H3
InChIKeyWIZFVFAZHIDOSY-UHFFFAOYSA-N
MW172.27 g/mol
LogP1.99
Rot. Bonds7

About 2-ethenyl-6-methoxy-2-methylhexan-1-ol

2-ethenyl-6-methoxy-2-methylhexan-1-ol (PubChem CID 102641801) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-ethenyl-6-methoxy-2-methylhexan-1-ol.

Molecular Properties

Compound Name2-ethenyl-6-methoxy-2-methylhexan-1-ol
PubChem CID102641801
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name2-ethenyl-6-methoxy-2-methylhexan-1-ol
SMILESC=CC(C)(CO)CCCCOC
InChIInChI=1S/C10H20O2/c1-4-10(2,9-11)7-5-6-8-12-3/h4,11H,1,5-9H2,2-3H3
InChIKeyWIZFVFAZHIDOSY-UHFFFAOYSA-N
XLogP1.99
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-[2-(3-methoxypropoxy)ethyl]-2-methylbut-3-en-1-ol
CID 103184970
2-ethenyl-5-methoxy-2,5-dimethylhexan-1-ol
CID 103018143
2-(6-methoxyhexoxy)-2-methylbut-3-en-1-ol
CID 170336565
2-(2-methoxyethyl)-2-methylbut-3-en-1-amine
CID 102640309
6-methoxy-2-methylhexan-2-amine
CID 94975413
3-(4-methoxybutylamino)-2,2-dimethylpropan-1-ol
CID 81410944
1,6-dimethoxy-6-methylheptane
CID 89190127
2-[2-[(4-bromophenyl)methoxy]ethyl]-2-methylbut-3-en-1-ol
CID 122228540
1-(3-methoxypropoxy)-2,2-dimethylpropane-1,3-diol;prop-2-enoic acid
CID 175711628
6-(8-hydroxy-3-methyloct-1-en-3-yl)oxy-6-methyloct-7-en-1-ol
CID 169099356
6-methoxy-2,2-dimethylhexan-1-amine
CID 104649285
6-(3-methoxypropoxy)-2-methyl-2-(propan-2-ylamino)hexan-1-ol
CID 64810830

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-6-methoxy-2-methylhexan-1-ol?
The IUPAC name of 2-ethenyl-6-methoxy-2-methylhexan-1-ol (CID 102641801) is 2-ethenyl-6-methoxy-2-methylhexan-1-ol.
What is the SMILES notation for 2-ethenyl-6-methoxy-2-methylhexan-1-ol?
The canonical SMILES for 2-ethenyl-6-methoxy-2-methylhexan-1-ol is C=CC(C)(CO)CCCCOC.
What is the InChIKey of 2-ethenyl-6-methoxy-2-methylhexan-1-ol?
The InChIKey is WIZFVFAZHIDOSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-4-10(2,9-11)7-5-6-8-12-3/h4,11H,1,5-9H2,2-3H3.
What are the key properties of 2-ethenyl-6-methoxy-2-methylhexan-1-ol?
2-ethenyl-6-methoxy-2-methylhexan-1-ol has a molecular weight of 172.27 g/mol, XLogP of 1.99, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-6-methoxy-2-methylhexan-1-ol is sourced from PubChem (CID 102641801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).