2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane

C16H30O7 — CID 15506995

IUPAC2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
SMILESCC1(COCCOCCOCCOCCOCC2(C)CO2)CO1
InChIInChI=1S/C16H30O7/c1-15(13-22-15)11-20-9-7-18-5-3-17-4-6-19-8-10-21-12-16(2)14-23-16/h3-14H2,1-2H3
InChIKeyKBANAJFHXNXPKE-UHFFFAOYSA-N
MW334.41 g/mol
LogP0.65
Rot. Bonds16

About 2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane

2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane (PubChem CID 15506995) has the molecular formula C16H30O7 and a molecular weight of 334.41 g/mol. Its IUPAC name is 2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane.

Molecular Properties

Compound Name2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
PubChem CID15506995
Molecular FormulaC16H30O7
Molecular Weight334.41 g/mol
Exact Mass334.20
IUPAC Name2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
SMILESCC1(COCCOCCOCCOCCOCC2(C)CO2)CO1
InChIInChI=1S/C16H30O7/c1-15(13-22-15)11-20-9-7-18-5-3-17-4-6-19-8-10-21-12-16(2)14-23-16/h3-14H2,1-2H3
InChIKeyKBANAJFHXNXPKE-UHFFFAOYSA-N
XLogP0.65
TPSA71.21 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds16
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.41
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

Neopentyl glycol diglycidyl ether
CID 28594
2,2'-(Oxybis((methyl-2,1-ethanediyl)oxymethylene))bis(oxirane)
CID 3034475
Ethylene glycol bis(2,3-epoxy-2-methylpropyl) ether
CID 235376
Propylene glycol diglycidyl ether homopolymer
CID 85959
1,3-Bis(2,3-epoxypropoxy)-2,2-bis((2,3-epoxypropoxy)methyl)propane
CID 76579
2,2'-(Oxybis(methylene))bis(2-methyloxirane)
CID 24075
Bis(2-(2,3-epoxy-2-methylpropoxy)ethyl ether
CID 15506994
2-({2-Methyl-3-(2-oxiranylmethoxy)-2-[(2-oxiranylmethoxy)methyl]propoxy}methyl)oxirane
CID 3423260
Tripropylene glycol diglycidyl ether
CID 19877096
2-[2-(2-Methoxyethoxy)ethoxymethyl]oxirane;oxirane
CID 158836372
Oxirane, 2,2'-((dimethyl-1,3-propanediyl)bis(oxymethylene))bis-
CID 6453146
Dipropyleneglycol diglycidyl ether
CID 19877092

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane?
The IUPAC name of 2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane (CID 15506995) is 2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane.
What is the SMILES notation for 2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane?
The canonical SMILES for 2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane is CC1(COCCOCCOCCOCCOCC2(C)CO2)CO1.
What is the InChIKey of 2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane?
The InChIKey is KBANAJFHXNXPKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30O7/c1-15(13-22-15)11-20-9-7-18-5-3-17-4-6-19-8-10-21-12-16(2)14-23-16/h3-14H2,1-2H3.
What are the key properties of 2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane?
2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane has a molecular weight of 334.41 g/mol, XLogP of 0.65, 16 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[2-[2-[2-[2-[(2-methyloxiran-2-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane is sourced from PubChem (CID 15506995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).