4-Methoxy-3-penten-2-one

C₆H₁₀O₂CAS 2845-83-2114.14 g/mol

Open in Covalent MOL file

Alkene Ether Ketone

Properties

Molecular formula: C₆H₁₀O₂
Molar mass: 114.14 g/mol
Exact mass: 114.0681 Da
logP: 1.13Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

2845-83-2

SMILES

CC(=CC(=O)C)OC

InChIKey

CDWAKLKSWYVUSL-UHFFFAOYSA-N

InChI

InChI=1S/C6H10O2/c1-5(7)4-6(2)8-3/h4H,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

4-Methoxypent-3-en-2-one

Reactions

4-METHOXY-3-PENTEN-2-ONE (3-Penten-2-one, 4-methoxy-)product

Work with 4-Methoxy-3-penten-2-one

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-[(Trimethylsilyl)oxy]-3-penten-2-one13257-81-354 % similar Mesityl oxide141-79-746 % similar 2-(tert-Butyldimethylsiloxy)pent-2-en-4-one69404-97-345 % similar 4-Amino-3-penten-2-one1118-66-741 % similar Methyl 3-[(trimethylsilyl)oxy]-2-butenoate62269-44-739 % similar 4-Methoxy-3-buten-2-one4652-27-139 % similar Methyl 3-methyl-2-butenoate924-50-539 % similar Mevinphos7786-34-736 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2,2-Dimethylbut-3-enoic acid10276-09-2 4-Methyl-2-pentenoic acid10321-71-8 Allyl glycidyl ether106-92-3 1,5-Hexadiene-3,4-diol1069-23-4 Hexanedial1072-21-5 Hexane-2,5-dione110-13-4 Beta-Methyl-delta-valerolactone1121-84-2 2-Hexenoic acid1191-04-4

Elsewhere

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