[2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate

C10H10O4 — CID 165349007

IUPAC[2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate
SMILESO=COc1ccccc1OC[C@H]1CO1
InChIInChI=1S/C10H10O4/c11-7-14-10-4-2-1-3-9(10)13-6-8-5-12-8/h1-4,7-8H,5-6H2/t8-/m1/s1
InChIKeyKZDHJLTZYDDJTF-MRVPVSSYSA-N
MW194.19 g/mol
LogP1.00
Rot. Bonds5

About [2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate

[2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate (PubChem CID 165349007) has the molecular formula C10H10O4 and a molecular weight of 194.19 g/mol. Its IUPAC name is [2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate.

Molecular Properties

Compound Name[2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate
PubChem CID165349007
Molecular FormulaC10H10O4
Molecular Weight194.19 g/mol
Exact Mass194.06
IUPAC Name[2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate
SMILESO=COc1ccccc1OC[C@H]1CO1
InChIInChI=1S/C10H10O4/c11-7-14-10-4-2-1-3-9(10)13-6-8-5-12-8/h1-4,7-8H,5-6H2/t8-/m1/s1
InChIKeyKZDHJLTZYDDJTF-MRVPVSSYSA-N
XLogP1.00
TPSA48.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 51.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

bis(2-[(2-methylphenoxy)methyl]oxirane);propane
CID 91036467
(2R)-2-[(2-iodophenoxy)methyl]oxirane
CID 57462593
[2-[[(2S,3R)-3-(chloromethyl)oxiran-2-yl]methoxy]phenyl] formate
CID 22809967
2-[(2-methylphenoxy)methyl]oxirane;oxiran-2-ylmethanol
CID 174918196
(2S)-2-[[2-[2,3,5,6-tetrafluoro-4-[2-[[(2R)-oxiran-2-yl]methoxy]phenoxy]phenoxy]phenoxy]methyl]oxirane
CID 2308866
3,4-bis(oxiran-2-ylmethoxy)benzaldehyde
CID 175734853
2-methyl-3-(oxiran-2-ylmethoxy)benzaldehyde
CID 91239700
4-(oxiran-2-ylmethoxy)naphthalene-1-carbaldehyde
CID 22999320
ethane;2-[[2-[[2-(oxiran-2-ylmethoxy)phenyl]methyl]phenoxy]methyl]oxirane
CID 158003640
1,3,5-tris[2-(oxiran-2-ylmethoxy)phenyl]-1,3,5-triazinane-2,4,6-trione
CID 15745049
2-[[2-[[2-(oxiran-2-ylmethoxy)-3-[[2-(oxiran-2-ylmethoxy)-3-[[2-(oxiran-2-ylmethoxy)phenyl]methyl]phenyl]methyl]phenyl]methyl]phenoxy]methyl]oxirane
CID 134322112
2-[[2-(2-methylprop-2-enoxy)phenoxy]methyl]oxirane
CID 13171806

Frequently Asked Questions

What is the IUPAC name of [2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate?
The IUPAC name of [2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate (CID 165349007) is [2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate.
What is the SMILES notation for [2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate?
The canonical SMILES for [2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate is O=COc1ccccc1OC[C@H]1CO1.
What is the InChIKey of [2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate?
The InChIKey is KZDHJLTZYDDJTF-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H10O4/c11-7-14-10-4-2-1-3-9(10)13-6-8-5-12-8/h1-4,7-8H,5-6H2/t8-/m1/s1.
What are the key properties of [2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate?
[2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate has a molecular weight of 194.19 g/mol, XLogP of 1.00, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[(2R)-oxiran-2-yl]methoxy]phenyl] formate is sourced from PubChem (CID 165349007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).