1,2,2,6,6-Pentamethyl-4-piperidyl methacrylate
Product Information
Molecular Formula
C14H25NO2
Molecular Weight
225.33
Description
1,2,2,6,6-Pentamethyl-4-piperidyl methacrylate, an element used extensively in biomedical realms, is inextricably dovetailed with the meticulous process of drug synthesis. It is widely used in drug formulation development for neurodegenerative diseases.
Synonyms
METHACRYLIC ACID 1,2,2,6,6-PENTAMETHYL-4-PIPERIDYL ESTER; 1,2,2,6,6-PENTAMETHYL-4-PIPERIDYL METHACRYLATE; 2-Propenoic acid,2-methyl-,1,2,2,6,6-pentamethyl-4-piperidinyl ester; 1,2,2,6,6-Pentamethyl-4-piperidinyl 2-methyl-2-propenoate; 1,2,2,6,6-Pentamethyl-4
IUPAC Name
(1,2,2,6,6-pentamethylpiperidin-4-yl) 2-methylprop-2-enoate
SMILES
CC(=C)C(=O)OC1CC(N(C(C1)(C)C)C)(C)C
InChI
InChI=1S/C14H25NO2/c1-10(2)12(16)17-11-8-13(3,4)15(7)14(5,6)9-11/h11H,1,8-9H2,2-7H3
InChI Key
NWPIOULNZLJZHU-UHFFFAOYSA-N
Flash Point
112 °C
Purity
>97.0%(GC)
Density
0.97
Appearance
Colorless to Light yellow clear liquid
Storage
0-10°C
Refractive Index
1.47
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Computed Properties
XLogP3
2.9
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
3
Exact Mass
239.188529040 g/mol
Monoisotopic Mass
239.188529040 g/mol
Topological Polar Surface Area
29.5Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
313
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
