4-[(3-Methacrylamidopropyl)dimethylammonio]butane-1-sulfonate
Product Information
Molecular Formula
C13H26N2O4S
Molecular Weight
306.42
Description
4-[(3-Methacrylamidopropyl)dimethylammonio]butane-1-sulfonate is a complex molecule widely used in biomedical research as a potential medicinal chemistry candidate for a variety of diseases, such as malignancy, inflammation, and cardiovascular dysfunction. The product has broad prospects. .
Synonyms
4-[[3-(Methacryloylamino)propyl](dimethyl)ammonio]-1-butanesulfonate
IUPAC Name
4-[dimethyl-[3-(2-methylprop-2-enoylamino)propyl]azaniumyl]butane-1-sulfonate
SMILES
CC(=C)C(=O)NCCC[N+](C)(C)CCCCS(=O)(=O)[O-]
InChI
InChI=1S/C13H26N2O4S/c1-12(2)13(16)14-8-7-10-15(3,4)9-5-6-11-20(17,18)19/h1,5-11H2,2-4H3,(H-,14,16,17,18,19)
InChI Key
YVECQSLRWYXZTR-UHFFFAOYSA-N
Purity
>98.0%(HPLC)(N)
Appearance
White to Almost white powder to crystaline
Storage
0-10°C
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
0.4
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
9
Exact Mass
306.16132849 g/mol
Monoisotopic Mass
306.16132849 g/mol
Topological Polar Surface Area
94.7Ų
Heavy Atom Count
20
Formal Charge
0
Complexity
411
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
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| WO-2022053752-A1 | Polymer of 2-acrylamido-2-methylpropane sulfonic acid or the salts thereof | 2020-09-11 |
| WO-2021099060-A1 | Method for preparing an inverse emulsion comprising two cationic polymers | 2019-11-19 |
| WO-2020245517-A1 | Method for preparing structured polymers in powder form by the gel process | 2019-06-05 |
| WO-2020229757-A1 | Novel process for filtering 2-acrylamido-2-methylpropane sulfonic acid | 2019-05-15 |
| DE-112020002390-T5 | NEW PROCESS FOR FILTRATION OF 2-ACRYLAMIDO-2-METHYLPROPANE SULFONIC ACID | 2019-05-15 |
| KR-20220009429-A | Novel process for filtering 2-acrylamido-2-methylpropane sulfonic acid | 2019-05-15 |
| WO-2020157429-A1 | Method for modifying the water permeability of a subterranean formation | 2019-02-01 |
| WO-2020157430-A1 | Method for modifying the water permeability of a subterranean formation | 2019-02-01 |
| US-2021362529-A1 | Lithographic printing plate precursor, method of preparing lithographic printing plate, and lithographic printing method | 2019-01-31 |
| WO-2020127568-A1 | Method for treating suspensions of solid particles in water using amphoteric polymers | 2018-12-20 |
