2-(6-methylhept-5-en-2-yloxy)ethanol

C10H20O2 — CID 13214227

IUPAC2-(6-methylhept-5-en-2-yloxy)ethanol
SMILESCC(C)=CCCC(C)OCCO
InChIInChI=1S/C10H20O2/c1-9(2)5-4-6-10(3)12-8-7-11/h5,10-11H,4,6-8H2,1-3H3
InChIKeyRRZMYECHGIZEKP-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.13
Rot. Bonds6

About 2-(6-methylhept-5-en-2-yloxy)ethanol

2-(6-methylhept-5-en-2-yloxy)ethanol (PubChem CID 13214227) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-(6-methylhept-5-en-2-yloxy)ethanol.

Molecular Properties

Compound Name2-(6-methylhept-5-en-2-yloxy)ethanol
PubChem CID13214227
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name2-(6-methylhept-5-en-2-yloxy)ethanol
SMILESCC(C)=CCCC(C)OCCO
InChIInChI=1S/C10H20O2/c1-9(2)5-4-6-10(3)12-8-7-11/h5,10-11H,4,6-8H2,1-3H3
InChIKeyRRZMYECHGIZEKP-UHFFFAOYSA-N
XLogP2.13
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(2S)-pentan-2-yl]oxyethanol
CID 89167429
3-(2-hydroxyethoxy)butyl formate
CID 88906039
(2S)-2-(2-hydroxyethoxy)propan-1-ol
CID 87093044
3,7-dimethyloct-6-en-1-ol;2-propan-2-yloxypropane
CID 174687264
6-methylhept-5-en-2-yl propanoate
CID 3020294
9-(3,7-dimethyloct-6-enoxy)nonan-1-ol
CID 175023026
(6R)-8,8-bis[(3R)-3,7-dimethyloct-6-enoxy]-2,6-dimethyloct-2-ene
CID 87863892
2-butan-2-yloxyethanol;rutherfordium
CID 164705656
2-[4-(2-aminoethoxy)butan-2-yloxy]ethanol
CID 138577092
2-pent-4-yn-2-yloxyethanol
CID 130124823
(4R)-4-propoxypentan-1-ol
CID 54320299
2-[2-[4-[(3S)-3,7-dimethyloct-6-enyl]piperazin-1-yl]ethoxy]ethanol
CID 30327049

Frequently Asked Questions

What is the IUPAC name of 2-(6-methylhept-5-en-2-yloxy)ethanol?
The IUPAC name of 2-(6-methylhept-5-en-2-yloxy)ethanol (CID 13214227) is 2-(6-methylhept-5-en-2-yloxy)ethanol.
What is the SMILES notation for 2-(6-methylhept-5-en-2-yloxy)ethanol?
The canonical SMILES for 2-(6-methylhept-5-en-2-yloxy)ethanol is CC(C)=CCCC(C)OCCO.
What is the InChIKey of 2-(6-methylhept-5-en-2-yloxy)ethanol?
The InChIKey is RRZMYECHGIZEKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-9(2)5-4-6-10(3)12-8-7-11/h5,10-11H,4,6-8H2,1-3H3.
What are the key properties of 2-(6-methylhept-5-en-2-yloxy)ethanol?
2-(6-methylhept-5-en-2-yloxy)ethanol has a molecular weight of 172.27 g/mol, XLogP of 2.13, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methylhept-5-en-2-yloxy)ethanol is sourced from PubChem (CID 13214227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).