1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane

C8H19O4P — CID 170850888

IUPAC1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane
SMILESCOCCOP(C)(=O)OCC(C)C
InChIInChI=1S/C8H19O4P/c1-8(2)7-12-13(4,9)11-6-5-10-3/h8H,5-7H2,1-4H3
InChIKeyMYDVJZHBVIUVNW-UHFFFAOYSA-N
MW210.21 g/mol
LogP2.14
Rot. Bonds7

About 1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane

1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane (PubChem CID 170850888) has the molecular formula C8H19O4P and a molecular weight of 210.21 g/mol. Its IUPAC name is 1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane.

Molecular Properties

Compound Name1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane
PubChem CID170850888
Molecular FormulaC8H19O4P
Molecular Weight210.21 g/mol
Exact Mass210.10
IUPAC Name1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane
SMILESCOCCOP(C)(=O)OCC(C)C
InChIInChI=1S/C8H19O4P/c1-8(2)7-12-13(4,9)11-6-5-10-3/h8H,5-7H2,1-4H3
InChIKeyMYDVJZHBVIUVNW-UHFFFAOYSA-N
XLogP2.14
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

2-methyl-1-[methyl(propoxy)phosphoryl]oxypropane
CID 86168978
1,2-bis[[methoxy(methyl)phosphoryl]oxy]ethane
CID 18714474
2-methyl-1-[methyl(2-methylbutoxy)phosphoryl]oxybutane
CID 170850967
1-[methyl(propoxy)phosphoryl]oxypropane
CID 566276
2-methoxyethoxy(methyl)phosphinate
CID 140680412
2-methylpropyl phosphate
CID 22629809
methyl 3-[methyl(2-methylpropoxy)phosphoryl]propanoate
CID 11862228
2-[ethoxy(methyl)phosphoryl]oxy-1-methoxypropane
CID 556594
3-[methoxy(methyl)phosphoryl]oxy-2-methylpropanoic acid
CID 126576964
1-[methoxy(methyl)phosphoryl]oxypropan-2-ol
CID 14451329
2-methyl-1-[methyl(2-methylpentoxy)phosphoryl]oxypentane
CID 566127
1-[bis(2-methylpropoxy)phosphorylsulfanyl-(2-methylpropoxy)phosphoryl]oxy-2-methylpropane
CID 134977347

Frequently Asked Questions

What is the IUPAC name of 1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane?
The IUPAC name of 1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane (CID 170850888) is 1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane.
What is the SMILES notation for 1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane?
The canonical SMILES for 1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane is COCCOP(C)(=O)OCC(C)C.
What is the InChIKey of 1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane?
The InChIKey is MYDVJZHBVIUVNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19O4P/c1-8(2)7-12-13(4,9)11-6-5-10-3/h8H,5-7H2,1-4H3.
What are the key properties of 1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane?
1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane has a molecular weight of 210.21 g/mol, XLogP of 2.14, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-methoxyethoxy(methyl)phosphoryl]oxy-2-methylpropane is sourced from PubChem (CID 170850888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).