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4-Piperidinecarboxylic acid, 2,2,6,6-tetramethyl-

HCID 103446
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
65728-19-0
Standard SMILES
CC1(C)CC(C(=O)O)CC(C)(C)N1
InChIKey
QKXWNEXHGMFIGB-UHFFFAOYSA-N
Molecular formula
C10H19NO2
Average molar mass
185.26 g/mol
Monoisotopic mass
185.14157885

Names & identifiers

Preferred name
4-Piperidinecarboxylic acid, 2,2,6,6-tetramethyl-
IUPAC
2,2,6,6-tetramethylpiperidine-4-carboxylic acid
English name
2,2,6,6-Tetramethylpiperidine-4-carboxylic acid, hydrochloride salt
Molecular formula
C10H19NO2
Molecular weight
185.26

Names & synonyms

65728-19-04-Piperidinecarboxylic acid, 2,2,6,6-tetramethyl-EINECS 265-895-42,2,6,6-Tetramethyl-4-piperidinecarboxylic acidDTXSID7070345RefChem:100393DTXCID10446492,2,6,6-Tetramethylpiperidine-4-carboxylic acidSCHEMBL83010SCHEMBL71886604-Carboxy-2,2,6,6-tetramethylpiperidineDB-191826
Show more names
2,2,6,6-Tetramethylpiperidine-4-carboxylic acid, hydrochloride salt
NS00035902EN300-1937382,2,6,6-Tetramethylpiperidine-4-carboxylicacid

Database identifiers

CAS
65728-19-0
PubChem CID
103446
DTXSID
DTXSID7070345
EC Number
265-895-4
Nikkaji
J307.468D

Properties

Computed structural properties

XLogP
-1.2
Topological polar surface area
49.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
205

Physicochemical properties

Melting point
320 °C · >320°C
Boiling point
275.7 · 275.7±33.0 °C(Predicted)
Density
0.967 · 0.967±0.06 g/cm3(Predicted)
storage temp.
-20 °C · -20°C Freezer
solubility
Methanol, Water
form
Solid
pka
4.07 · 4.07±0.60(Predicted)
color
Off- White
CAS DataBase Reference
65728 · 65728-19-0
EPA Substance Registry System
4 · 4-Piperidinecarboxylic acid, 2,2,6,6-tetramethyl- (65728-19-0)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
TSCA
TSCA listed

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

tsca
TSCA listed
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Uses & manufacturing

General Manufacturing Information4-Piperidinecarboxylic acid, 2,2,6,6-tetramethyl-: INACTIVE

Related reactions

2 records
New reaction record
HRID 1119371 reaction equation
HRID 1119371As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1164385 reaction equation
HRID 1164385As reactantuspto-grants-1983_01

Compound notes

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