2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol

C10H16O2 — CID 123384994

IUPAC2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol
SMILESC=C1OC(CCO)CCC1=CC
InChIInChI=1S/C10H16O2/c1-3-9-4-5-10(6-7-11)12-8(9)2/h3,10-11H,2,4-7H2,1H3
InChIKeyXOJNQGHKNSNGTG-UHFFFAOYSA-N
MW168.24 g/mol
LogP2.01
Rot. Bonds2

About 2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol

2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol (PubChem CID 123384994) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is 2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol.

Molecular Properties

Compound Name2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol
PubChem CID123384994
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol
SMILESC=C1OC(CCO)CCC1=CC
InChIInChI=1S/C10H16O2/c1-3-9-4-5-10(6-7-11)12-8(9)2/h3,10-11H,2,4-7H2,1H3
InChIKeyXOJNQGHKNSNGTG-UHFFFAOYSA-N
XLogP2.01
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2S)-3,4-dihydro-2H-chromen-2-yl]ethanol
CID 54393265
6-(2-hydroxyethyl)-1,3-oxazinane-2-thione
CID 117274597
2-(2,2-dimethyl-1,3-dioxan-4-yl)ethanol
CID 18471524
methane;methanediol;bis(2-(oxiran-2-yl)ethanol);bis(yttrium)
CID 159329704
2-[(2R,3R,4R)-4-ethoxy-2-methoxy-7-methylideneoxepan-3-yl]ethanol
CID 89338542
2-[(1S,5R)-2-methylidene-5-(2-methyloxiran-2-yl)cyclohexyl]ethanol
CID 130991407
ethane;5-(hydroxymethyl)oxolan-2-one
CID 142985862
2-(5,6-dimethyloxan-2-yl)ethanol
CID 59772049
(4R,6R)-6-(2-hydroxyethyl)-4-methyloxan-2-one
CID 44603863
(5-methylideneoxolan-2-yl)methanamine;propane-2,2-diol
CID 156802298
2-(2-ethenyl-2-methyl-6-methylidenecyclohexyl)ethanol
CID 85287719
2-[6-(2-hydroxyethyl)-2,2-dimethyl-1,3-dioxan-4-yl]ethanol
CID 71346024

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol?
The IUPAC name of 2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol (CID 123384994) is 2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol.
What is the SMILES notation for 2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol?
The canonical SMILES for 2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol is C=C1OC(CCO)CCC1=CC.
What is the InChIKey of 2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol?
The InChIKey is XOJNQGHKNSNGTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-3-9-4-5-10(6-7-11)12-8(9)2/h3,10-11H,2,4-7H2,1H3.
What are the key properties of 2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol?
2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol has a molecular weight of 168.24 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethylidene-6-methylideneoxan-2-yl)ethanol is sourced from PubChem (CID 123384994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).