1-[(4-Methylphenyl)sulfonyl]-4-piperidinecarboxylic acid
Properties
- Molecular formula
- C13H17NO4S
- Molar mass
- 283.34 g/mol
- Exact mass
- 283.0878 Da
- Melting point
- 169–171 °C (decomposes)
- logP
- 1.48Crippen estimate
- Polar surface area
- 74.7 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 3
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
147636-36-0SMILES
Cc1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1InChIKey
YJRQMKSUAIKDDF-UHFFFAOYSA-NInChI
InChI=1S/C13H17NO4S/c1-10-2-4-12(5-3-10)19(17,18)14-8-6-11(7-9-14)13(15)16/h2-5,11H,6-9H2,1H3,(H,15,16)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- 4-Piperidinecarboxylic acid, 1-[(4-methylphenyl)sulfonyl]-
- 1-Tosylpiperidine-4-carboxylic acid
- 1-(4-Methylbenzenesulfonyl)piperidine-4-carboxylic acid
- 1-((4-Methylphenyl)sulfonyl)-4-piperidinecarboxylic acid
Work with 1-[(4-Methylphenyl)sulfonyl]-4-piperidinecarboxylic acid
Similar compounds
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1-[(4-Methylphenyl)sulfonyl]piperazine27106-51-053 % similar
N,N-Bis(2-chloroethyl)-4-methylbenzenesulfonamide42137-88-253 % similar
N-Tosyl-2,5-dihydropyrrole16851-72-249 % similar
1-(4-Methylphenyl)-5-oxopyrrolidine-3-carboxylic acid133747-57-648 % similar
Probenecid57-66-945 % similar
N-[(4-Methylphenyl)sulfonyl]-L-glutamic acid4816-80-244 % similar
1-Methyl-piperidine-4-carboxylic acid68947-43-343 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds