bis(2-(methoxymethyl)oxirane);styrene

C24H32O4 — CID 174797956

IUPACbis(2-(methoxymethyl)oxirane);styrene
SMILESC=Cc1ccccc1.C=Cc1ccccc1.COCC1CO1.COCC1CO1
InChIInChI=1S/2C8H8.2C4H8O2/c2*1-2-8-6-4-3-5-7-8;2*1-5-2-4-3-6-4/h2*2-7H,1H2;2*4H,2-3H2,1H3
InChIKeyVUSRADCJUPUNKN-UHFFFAOYSA-N
MW384.52 g/mol
LogP4.72
Rot. Bonds6

About bis(2-(methoxymethyl)oxirane);styrene

bis(2-(methoxymethyl)oxirane);styrene (PubChem CID 174797956) has the molecular formula C24H32O4 and a molecular weight of 384.52 g/mol. Its IUPAC name is bis(2-(methoxymethyl)oxirane);styrene.

Molecular Properties

Compound Namebis(2-(methoxymethyl)oxirane);styrene
PubChem CID174797956
Molecular FormulaC24H32O4
Molecular Weight384.52 g/mol
Exact Mass384.23
IUPAC Namebis(2-(methoxymethyl)oxirane);styrene
SMILESC=Cc1ccccc1.C=Cc1ccccc1.COCC1CO1.COCC1CO1
InChIInChI=1S/2C8H8.2C4H8O2/c2*1-2-8-6-4-3-5-7-8;2*1-5-2-4-3-6-4/h2*2-7H,1H2;2*4H,2-3H2,1H3
InChIKeyVUSRADCJUPUNKN-UHFFFAOYSA-N
XLogP4.72
TPSA43.52 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.52
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(2-(methoxymethyl)oxirane);styrene?
The IUPAC name of bis(2-(methoxymethyl)oxirane);styrene (CID 174797956) is bis(2-(methoxymethyl)oxirane);styrene.
What is the SMILES notation for bis(2-(methoxymethyl)oxirane);styrene?
The canonical SMILES for bis(2-(methoxymethyl)oxirane);styrene is C=Cc1ccccc1.C=Cc1ccccc1.COCC1CO1.COCC1CO1.
What is the InChIKey of bis(2-(methoxymethyl)oxirane);styrene?
The InChIKey is VUSRADCJUPUNKN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H8.2C4H8O2/c2*1-2-8-6-4-3-5-7-8;2*1-5-2-4-3-6-4/h2*2-7H,1H2;2*4H,2-3H2,1H3.
What are the key properties of bis(2-(methoxymethyl)oxirane);styrene?
bis(2-(methoxymethyl)oxirane);styrene has a molecular weight of 384.52 g/mol, XLogP of 4.72, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-(methoxymethyl)oxirane);styrene is sourced from PubChem (CID 174797956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).