[2-(methoxymethoxy)phenyl] methyl carbonate

C10H12O5 — CID 129163810

IUPAC[2-(methoxymethoxy)phenyl] methyl carbonate
SMILESCOCOc1ccccc1OC(=O)OC
InChIInChI=1S/C10H12O5/c1-12-7-14-8-5-3-4-6-9(8)15-10(11)13-2/h3-6H,7H2,1-2H3
InChIKeyQEKYWXHCINSPSU-UHFFFAOYSA-N
MW212.20 g/mol
LogP1.81
Rot. Bonds4

About [2-(methoxymethoxy)phenyl] methyl carbonate

[2-(methoxymethoxy)phenyl] methyl carbonate (PubChem CID 129163810) has the molecular formula C10H12O5 and a molecular weight of 212.20 g/mol. Its IUPAC name is [2-(methoxymethoxy)phenyl] methyl carbonate.

Molecular Properties

Compound Name[2-(methoxymethoxy)phenyl] methyl carbonate
PubChem CID129163810
Molecular FormulaC10H12O5
Molecular Weight212.20 g/mol
Exact Mass212.07
IUPAC Name[2-(methoxymethoxy)phenyl] methyl carbonate
SMILESCOCOc1ccccc1OC(=O)OC
InChIInChI=1S/C10H12O5/c1-12-7-14-8-5-3-4-6-9(8)15-10(11)13-2/h3-6H,7H2,1-2H3
InChIKeyQEKYWXHCINSPSU-UHFFFAOYSA-N
XLogP1.81
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phenyl_carbonate', 'substructure': 'N/A'}

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Related Compounds

[3-(methoxymethoxy)naphthalen-2-yl] methyl carbonate
CID 70288706
(2-ethylphenyl) methyl carbonate
CID 67179071
2,2-difluoro-1-[2-(methoxymethoxy)phenyl]ethanone
CID 171367812
(2-iodophenyl) methyl carbonate
CID 102340361
[2-(bromomethyl)phenyl] methyl carbonate
CID 122649168
[2-[hydroxy(methoxy)methoxy]phenyl] methyl carbonate
CID 129163738
(2-acetylphenyl) methyl carbonate
CID 14493761
[3-(ethoxymethoxy)naphthalen-2-yl] methyl carbonate
CID 70288635
1-[2-(methoxymethoxy)phenyl]propan-1-one
CID 15053855
[2-[3-[3-methoxy-2-(methoxymethoxy)phenyl]prop-2-ynoyl]phenyl] methyl carbonate
CID 102340360
[2-(methoxymethoxy)phenyl]methanol
CID 10920904
(2,3-dimethoxyphenyl) methyl carbonate
CID 19833381

Frequently Asked Questions

What is the IUPAC name of [2-(methoxymethoxy)phenyl] methyl carbonate?
The IUPAC name of [2-(methoxymethoxy)phenyl] methyl carbonate (CID 129163810) is [2-(methoxymethoxy)phenyl] methyl carbonate.
What is the SMILES notation for [2-(methoxymethoxy)phenyl] methyl carbonate?
The canonical SMILES for [2-(methoxymethoxy)phenyl] methyl carbonate is COCOc1ccccc1OC(=O)OC.
What is the InChIKey of [2-(methoxymethoxy)phenyl] methyl carbonate?
The InChIKey is QEKYWXHCINSPSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O5/c1-12-7-14-8-5-3-4-6-9(8)15-10(11)13-2/h3-6H,7H2,1-2H3.
What are the key properties of [2-(methoxymethoxy)phenyl] methyl carbonate?
[2-(methoxymethoxy)phenyl] methyl carbonate has a molecular weight of 212.20 g/mol, XLogP of 1.81, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methoxymethoxy)phenyl] methyl carbonate is sourced from PubChem (CID 129163810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).