4-ethylbenzene-1,3-diol;methoxymethane

C10H16O3 — CID 70585876

IUPAC4-ethylbenzene-1,3-diol;methoxymethane
SMILESCCc1ccc(O)cc1O.COC
InChIInChI=1S/C8H10O2.C2H6O/c1-2-6-3-4-7(9)5-8(6)10;1-3-2/h3-5,9-10H,2H2,1H3;1-2H3
InChIKeyUJJSXLWLXLNXHF-UHFFFAOYSA-N
MW184.23 g/mol
LogP1.92
Rot. Bonds1

About 4-ethylbenzene-1,3-diol;methoxymethane

4-ethylbenzene-1,3-diol;methoxymethane (PubChem CID 70585876) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is 4-ethylbenzene-1,3-diol;methoxymethane.

Molecular Properties

Compound Name4-ethylbenzene-1,3-diol;methoxymethane
PubChem CID70585876
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Name4-ethylbenzene-1,3-diol;methoxymethane
SMILESCCc1ccc(O)cc1O.COC
InChIInChI=1S/C8H10O2.C2H6O/c1-2-6-3-4-7(9)5-8(6)10;1-3-2/h3-5,9-10H,2H2,1H3;1-2H3
InChIKeyUJJSXLWLXLNXHF-UHFFFAOYSA-N
XLogP1.92
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.23
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethylbenzene-1,3-diol
CID 17927
(2,4-dihydroxyphenyl)methyl acetate
CID 102447193
4-(2,4-diethyl-5-hydroxyphenyl)benzene-1,3-diol
CID 101303234
4-[[(2-ethylphenyl)methylamino]methyl]benzene-1,3-diol
CID 64680284
2-ethyl-5-(4-methoxybutoxy)phenol
CID 135193551
3-amino-4-ethylphenol;hydrochloride
CID 178200309
ethane;4-(fluoromethyl)benzene-1,3-diol
CID 172565118
ethane;2-ethyl-5-methylphenol
CID 142001660
2-ethyl-5-[2-(4-ethyl-3-hydroxyphenyl)ethyl]phenol
CID 138634865
CID 156645550
CID 156645550
4-(2,3-diethyl-6-hydroxyphenyl)benzene-1,3-diol
CID 101303229
4-(sulfanylmethyl)benzene-1,3-diol
CID 57214402

Frequently Asked Questions

What is the IUPAC name of 4-ethylbenzene-1,3-diol;methoxymethane?
The IUPAC name of 4-ethylbenzene-1,3-diol;methoxymethane (CID 70585876) is 4-ethylbenzene-1,3-diol;methoxymethane.
What is the SMILES notation for 4-ethylbenzene-1,3-diol;methoxymethane?
The canonical SMILES for 4-ethylbenzene-1,3-diol;methoxymethane is CCc1ccc(O)cc1O.COC.
What is the InChIKey of 4-ethylbenzene-1,3-diol;methoxymethane?
The InChIKey is UJJSXLWLXLNXHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O2.C2H6O/c1-2-6-3-4-7(9)5-8(6)10;1-3-2/h3-5,9-10H,2H2,1H3;1-2H3.
What are the key properties of 4-ethylbenzene-1,3-diol;methoxymethane?
4-ethylbenzene-1,3-diol;methoxymethane has a molecular weight of 184.23 g/mol, XLogP of 1.92, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylbenzene-1,3-diol;methoxymethane is sourced from PubChem (CID 70585876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).