5,5-Dimethylpiperidine-2-carboxylic acid
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Basic information
- CAS
676355-70-7- Standard SMILES
CC1(C)CCC(C(=O)O)NC1- InChIKey
RNCALCQUIUHJEP-UHFFFAOYSA-N- Molecular formula
- C8H15NO2
- Average molar mass
- 157.21 g/mol
- Monoisotopic mass
- 157.11027872
Names & identifiers
- Preferred name
- 5,5-Dimethylpiperidine-2-carboxylic acid
- IUPAC
- 5,5-dimethylpiperidine-2-carboxylic acid
- English name
- 2-Piperidinecarboxylicacid,5,5-dimethyl-(9CI)
- Molecular formula
- C8H15NO2
- Molecular weight
- 157.21
Names & synonyms
5,5-Dimethylpiperidine-2-carboxylic acid676355-70-72-PIPERIDINECARBOXYLIC ACID, 5,5-DIMETHYL-SCHEMBL5781957DTXSID70601220RNCALCQUIUHJEP-UHFFFAOYSA-NSB427925,5-Dimethylpiperidine-2-carboxylicacidDB-282207EN300-300676(RS)-5,5-Dimethyl-piperidine-2-carboxylic acid2-Piperidinecarboxylicacid,5,5-dimethyl-(9CI)
Database identifiers
- CAS
676355-70-7- PubChem CID
- 19909698
- DTXSID
DTXSID70601220
Properties
Computed structural propertiesFilling in
- XLogP
- -1.2
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 165
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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