(2-ethoxy-1,3-dioxol-4-yl)methanol

C6H10O4 — CID 166068732

IUPAC(2-ethoxy-1,3-dioxol-4-yl)methanol
SMILESCCOC1OC=C(CO)O1
InChIInChI=1S/C6H10O4/c1-2-8-6-9-4-5(3-7)10-6/h4,6-7H,2-3H2,1H3
InChIKeyXXTANRWONGNSID-UHFFFAOYSA-N
MW146.14 g/mol
LogP0.19
Rot. Bonds3

About (2-ethoxy-1,3-dioxol-4-yl)methanol

(2-ethoxy-1,3-dioxol-4-yl)methanol (PubChem CID 166068732) has the molecular formula C6H10O4 and a molecular weight of 146.14 g/mol. Its IUPAC name is (2-ethoxy-1,3-dioxol-4-yl)methanol.

Molecular Properties

Compound Name(2-ethoxy-1,3-dioxol-4-yl)methanol
PubChem CID166068732
Molecular FormulaC6H10O4
Molecular Weight146.14 g/mol
Exact Mass146.06
IUPAC Name(2-ethoxy-1,3-dioxol-4-yl)methanol
SMILESCCOC1OC=C(CO)O1
InChIInChI=1S/C6H10O4/c1-2-8-6-9-4-5(3-7)10-6/h4,6-7H,2-3H2,1H3
InChIKeyXXTANRWONGNSID-UHFFFAOYSA-N
XLogP0.19
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.14
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Dioxol-5-ylmethanol
CID 17868908
2-(Methoxymethoxy)prop-2-en-1-ol
CID 10678218
4-(Hydroxymethyl)-1,3-dioxol-2-one
CID 19373541
(2,2-Dimethyl-1,3-dioxol-4-yl)methanol
CID 20552367
2-(Prop-1-en-2-yloxymethoxy)ethanol
CID 21053381
2-(Butan-2-yloxymethoxy)prop-2-en-1-ol
CID 23524656
(Z)-2-(methoxymethoxy)but-2-ene-1,3-diol
CID 88203270
(5-Methyl-1,3-dioxol-4-yl)methanol
CID 123637667
(2-Methoxy-2-methyl-1,3-dioxol-4-yl)methanol
CID 140972174
(2-Methoxy-1,3-dioxol-4-yl)methanol
CID 140972175
[5-(Hydroxymethyl)-1,3-dioxol-4-yl]methanol
CID 140981335
1-(2,2-Dimethyl-1,3-dioxol-4-yl)ethanol
CID 141047571

Frequently Asked Questions

What is the IUPAC name of (2-ethoxy-1,3-dioxol-4-yl)methanol?
The IUPAC name of (2-ethoxy-1,3-dioxol-4-yl)methanol (CID 166068732) is (2-ethoxy-1,3-dioxol-4-yl)methanol.
What is the SMILES notation for (2-ethoxy-1,3-dioxol-4-yl)methanol?
The canonical SMILES for (2-ethoxy-1,3-dioxol-4-yl)methanol is CCOC1OC=C(CO)O1.
What is the InChIKey of (2-ethoxy-1,3-dioxol-4-yl)methanol?
The InChIKey is XXTANRWONGNSID-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O4/c1-2-8-6-9-4-5(3-7)10-6/h4,6-7H,2-3H2,1H3.
What are the key properties of (2-ethoxy-1,3-dioxol-4-yl)methanol?
(2-ethoxy-1,3-dioxol-4-yl)methanol has a molecular weight of 146.14 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethoxy-1,3-dioxol-4-yl)methanol is sourced from PubChem (CID 166068732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).