Basic information
- CAS
1449-89-4- Standard SMILES
CC12COP(=O)(OC1)OC2- InChIKey
SEOXVQTUPVKLTH-UHFFFAOYSA-N- Molecular formula
- C5H9O4P
- Average molar mass
- 164.1 g/mol
- Monoisotopic mass
- 164.02384576
Overview
structure
Names & identifiers
- Preferred name
- 2,6,7-Trioxa-1-phosphabicyclo(2.2.2)octane, 4-methyl-, 1-oxide
- IUPAC
- 4-methyl-2,6,7-trioxa-1λ5-phosphabicyclo[2.2.2]octane 1-oxide
- English name
- MEBICYPHAT
- Molecular formula
- C5H9O4P
- Molecular weight
- 164.1
Names & synonyms
Methyl bicyclophosphate1449-89-42,6,7-TRIOXA-1-PHOSPHABICYCLO(2.2.2)OCTANE, 4-METHYL-, 1-OXIDERefChem:908848MethylbicyclophosphateMEBICYPHAT4-methyl-2,6,7-trioxa-1lambda5-phosphabicyclo[2.2.2]octane 1-oxide4-Methyl-1-oxo-1-phospha-2,6,7-trioxabicyclo(2.2.2)octane1,3-Propanediol, 2-(hydroxymethyl)-2-methyl-, cyclic phosphate (1:1)4-Methyl-2,6,7-trioxa-1-phosphabicyclo(2.2.2)octane-1-oxideBRN 19097704-Methyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-1-oxide
Show more names
MEBICYPHAT 98%6,7-trioxa-1-phosphabicyclo(2.2.2)octane,4-methyl-1-oxide4-Methyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane1-oxide2,6,7-Trioxa-1-phosphabicyclo[2.2.2]octane, 4-methyl-, 1-oxide4-methyl-2,6,7-trioxa-1$l^{5}-phosphabicyclo[2.2.2]octane 1-oxide
4-Isopropyl-1-phospha-2,6,7-trioxabicyclo(2.2.2)octane 1-oxide4-Isopropyl-1-phospha-2,6,7-trioxabicyclo(2.2.2)octane-1-oxide4-Methyl-2,6,7-trioxa-1-fosfabicyklo(2.2.2)oktan-1-oxid [Czech]SCHEMBL10080814DTXSID90932447SEOXVQTUPVKLTH-UHFFFAOYSA-N4-Methyl-2,6,7-trioxa-1-fosfabicyklo(2.2.2)oktan-1-oxid4-Methyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane 1-oxide
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 171
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Chemistry & industry
Suppliers2 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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