chempirical

Methyl tetrahydropyran-4-carboxylate

C7H12O3CAS 110238-91-0144.17 g/mol

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Properties

Molecular formula
C7H12O3
Molar mass
144.17 g/mol
Exact mass
144.0786 Da
Melting point
78 °C
Boiling point
80.5–81 °C (at 16 Torr)
logP
0.59Crippen estimate
Polar surface area
35.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

Identifiers

CAS number
110238-91-0
SMILES
COC(=O)C1CCOCC1
InChIKey
CNCMVGXVKBJYNU-UHFFFAOYSA-N
InChI
InChI=1S/C7H12O3/c1-9-7(8)6-2-4-10-5-3-6/h6H,2-5H2,1H3

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Names and synonyms

5 names
  • 2H-Pyran-4-carboxylic acid, tetrahydro-, methyl ester
  • Tetrahydropyran-4-carboxylic acid methyl ester
  • Methyl tetrahydro-2H-pyran-4-carboxylate
  • 4-(Methoxycarbonyl)tetrahydropyran
  • Tetrahydro-2H-pyran-4-carboxylic acid methyl ester

Work with Methyl tetrahydropyran-4-carboxylate

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

Same formula

Ethyl 3-ethoxy-2-propenoate1001-26-9 4-(2-Hydroxypropoxy)-2-butyn-1-ol1606-79-7 Ethyl tetrahydrofuroate16874-34-3 4-Hydroxycyclohexanecarboxylic acid17419-81-7 Ethyl 3-methyl-2-oxobutanoate20201-24-5 4-Hydroxybutyl acrylate2478-10-6 Polyethylene glycol methyl ether methacrylate26915-72-0 Methyl 3-oxohexanoate30414-54-1

Elsewhere

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