Tetrahydropyran-2-carboxylic acid

C₆H₁₀O₃CAS 51673-83-7130.14 g/mol

Open in Covalent MOL file

Carboxylic acid Ether

Properties

Molecular formula: C₆H₁₀O₃
Molar mass: 130.14 g/mol
Exact mass: 130.0630 Da
logP: 0.64Crippen estimate
Polar surface area: 46.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

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

51673-83-7

SMILES

C1CCOC(C1)C(=O)O

InChIKey

MQAYFGXOFCEZRW-UHFFFAOYSA-N

InChI

InChI=1S/C6H10O3/c7-6(8)5-3-1-2-4-9-5/h5H,1-4H2,(H,7,8)

Weigh it out

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Names and synonyms

1 names

Oxane-2-carboxylic acid

Work with Tetrahydropyran-2-carboxylic acid

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

Tetrahydro-2-furoic acid16874-33-288 % similar (R)-(+)-2-Tetrahydrofuroic acid87392-05-088 % similar (2S)-Tetrahydro-2-furancarboxylic acid87392-07-288 % similar Oxetane-2-carboxylic acid864373-47-772 % similar 1,2-Cyclohexanedicarboxylic acid1687-30-548 % similar (±)-trans-1,2-Cyclohexanedicarboxylic acid2305-32-048 % similar Cyclopentanecarboxylic acid3400-45-148 % similar (1R,2R)-(-)-1,2-Cyclohexanedicarboxylic acid46022-05-348 % similar

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

Same formula

Ethyl 2-(hydroxymethyl)-2-propenoate10029-04-6 Ethyl 4-hydroxycrotonate10080-68-9 Ethyl (2S)-2-oxiraneacetate112083-63-3 Propionic anhydride123-62-6 3-(2-Propyn-1-yloxy)-1,2-propanediol13580-38-6 2-Hydroxyadipaldehyde141-31-1 Ethyl acetoacetate141-97-9 (±)-3-Methyl-2-oxovaleric acid1460-34-0

Elsewhere

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