1-Butene, 3-methoxy-3-methyl-
Basic information
- CAS
40426-44-6- Standard SMILES
C=CC(C)(C)OC- InChIKey
KZFIDRJBGCIAOG-UHFFFAOYSA-N- Molecular formula
- C6H12O
- Average molar mass
- 100.16 g/mol
- Monoisotopic mass
- 100.088815
Names & identifiers
- Preferred name
- 1-Butene, 3-methoxy-3-methyl-
- IUPAC
- 3-methoxy-3-methylbut-1-ene
- English name
- Methyl(2-methyl-3-butene-2-yl) ether
- Molecular formula
- C6H12O
- Molecular weight
- 100.16
Names & synonyms
40426-44-61-Butene, 3-methoxy-3-methyl-DTXSID80339805RefChem:1055148DTXCID802908863-methoxy-3-methylbut-1-ene2-Methoxy-2-methylbut-3-ene3-Methoxy-3-methyl-1-buteneMethyl(2-methyl-3-butene-2-yl) etherSCHEMBL1342312-methoxy-2-methyl-3-buteneSCHEMBL1790204
Show more names
SCHEMBL7028383KZFIDRJBGCIAOG-UHFFFAOYSA-N1,1-Dimethyl-2-propenyl methyl ether #
Database identifiers
- CAS
40426-44-6- PubChem CID
- 558909
- DTXSID
DTXSID80339805- Nikkaji
- J27.125J
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 64.6
Physicochemical properties
- Boiling point
- 80 · 80-83 °C
- Density
- 0.7823 g/cm3 · 0.7823 g/cm3
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Related reactions
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Compound notes
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