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| CAS No.: | 2482-00-0 |
|---|---|
| Name: | Agmatine sulfate |
| Article Data: | 3 |
| Molecular Structure: | |
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| Formula: | C5H16N4O4S |
| Molecular Weight: | 228.272 |
| Synonyms: | 2-(4-aminobutyl)guanidine; sulfuric acid;Prestwick_710;Guanidine, (4-aminobutyl)-, sulfate (1:1);(4-Aminobutyl)guanidinium sulphate;1-Amino-4-guanidinobutane sulfate salt;(4-Aminobutyl)guanidine sulphate; |
| EINECS: | 219-617-3 |
| Melting Point: | 234-238 °C(lit.) |
| Boiling Point: | 281.4 °C at 760 mmHg |
| Flash Point: | 124 °C |
| Solubility: | 50 mg/mL in water |
| Appearance: | Powder |
| Safety: | 22-24/25 |
| PSA: | 170.90000 |
| LogP: | 1.52760 |
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- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- 852475-26-4MC1568
| Conditions | Yield |
|---|---|
| Stage #1: agmatine sulphate With potassium carbonate In water at 0 - 5℃; for 0.166667h; Stage #2: acryloyl chloride In water; acetone at 5℃; for 1h; Stage #3: With sulfuric acid; potassium carbonate Product distribution / selectivity; more than 3 stages; | 95% |
| Stage #1: agmatine sulphate With sodium hydroxide In water at 0℃; pH=12; Stage #2: acryloyl chloride With sodium hydroxide In water; acetone at 0 - 20℃; for 2h; pH=11.8; Stage #3: With sulfuric acid In water; acetone pH=2.5; Product distribution / selectivity; | 50% |
| Stage #1: agmatine sulphate With potassium carbonate In water at 5℃; for 0.166667h; Cooling with ice; Stage #2: acryloyl chloride In water; acetone at 5℃; for 1h; | |
| With sodium hydrogencarbonate In water at 0℃; for 1.5h; | 1 g |
| Stage #1: agmatine sulphate; acryloyl chloride With sodium hydrogencarbonate at 0℃; for 1h; Stage #2: With hydrogenchloride In water pH=1; | 1 g |
- 34071-95-9
N-succinimidyl-3-(p-hydroxyphenyl)propionate
- 2482-00-0
agmatine sulphate
| Conditions | Yield |
|---|---|
| With sodium hydrogencarbonate In acetone for 19h; pH=8; | 91% |
- 2482-00-0
agmatine sulphate
| Conditions | Yield |
|---|---|
| With triethylamine In ethanol; water at 20℃; for 20h; Inert atmosphere; Reflux; | 82% |
- 2482-00-0
agmatine sulphate
- 672341-25-2
4-O-metyl-cis-p-coumaryl succinimide ester
| Conditions | Yield |
|---|---|
| With sodium hydrogencarbonate In acetone for 72h; pH=8.0; | 81% |
- 26272-90-2
cetyl chloroformate
- 2482-00-0
agmatine sulphate
| Conditions | Yield |
|---|---|
| Stage #1: agmatine sulphate With sodium hydroxide In water; isopropyl alcohol at 10 - 20℃; pH=12 - 13; Stage #2: cetyl chloroformate With hydrogenchloride In ethyl acetate at 20℃; for 0.5h; | 72% |
- 24424-99-5
di-tert-butyl dicarbonate
- 2482-00-0
agmatine sulphate
| Conditions | Yield |
|---|---|
| With sodium hydrogencarbonate In 1,4-dioxane | 68% |
| With sodium hydrogencarbonate In 1,4-dioxane at 20℃; | 68% |
- 2482-00-0
agmatine sulphate
- 88492-43-7
4-hydroxycinnamic acid N-hydroxysuccinimide ester
| Conditions | Yield |
|---|---|
| With sodium hydrogencarbonate In water; acetone for 24h; Ambient temperature; pH: 8; | 65% |
- 2482-00-0
agmatine sulphate
- 116115-11-8
(S)-2-Benzyloxycarbonylamino-5-tert-butoxycarbonylamino-pentanoic acid 2,5-dioxo-pyrrolidin-1-yl ester
| Conditions | Yield |
|---|---|
| With triethylamine In water; acetonitrile | 51% |
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- 141-52-6Ethanol, sodium salt(1:1)
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- 104987-11-3Tacrolimus
- 141-53-7Sodium formate
- 8001-54-5Quaternary ammonium compounds, alkylbenzyldimethyl, chlorides
- 9003-39-8Povidone
- 10161-34-9Trenbolone acetate
- 402957-28-2Telaprevir
- 68-19-9Cyanocobalamin
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Chemistry
The molecular structure of Agmatine sulfate (CAS NO.2482-00-0):
IUPAC Name: 2-(4-Aminobutyl)guanidine; sulfuric acid
Molecular Weight: 228.26994 g/mol
Molecular Formula: C5H16N4O4S
Melting Point: 234-238 °C(lit.)
Flash Point: 124 °C
Enthalpy of Vaporization: 52.02 kJ/mol
Boiling Point: 281.4 °C at 760 mmHg
Vapour Pressure: 0.00357 mmHg at 25 °C
Storage Temp.: −20 °C
Water Solubility: 50 mg/mL
H-Bond Donor: 5
H-Bond Acceptor: 8
Rotatable Bond Count: 4
Tautomer Count: 2
Exact Mass: 228.089226
MonoIsotopic Mass: 228.089226
Topological Polar Surface Area: 165
Heavy Atom Count: 14
Canonical SMILES: C(CCN=C(N)N)CN.OS(=O)(=O)O
InChI: InChI=1S/C5H14N4.H2O4S/c6-3-1-2-4-9-5(7)8;1-5(2,3)4/h1-4,6H2,(H4,7,8,9);(H2,1,2,3,4)
InChIKey: PTAYFGHRDOMJGC-UHFFFAOYSA-N
EINECS: 219-617-3
Product Categories: Active Pharmaceutical Ingredients;Imidazoline binding site
Safety Profile
Safety Statements: 22-24/25
S22:Do not breathe dust.
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3
F: 10
Specification
Agmatine sulfate (CAS NO.2482-00-0) is also named as AI3-51851 ; (4-Aminobutyl)guanidinium sulphate ; Guanidine, (4-aminobutyl)-, sulfate (1:1) ; 1-(4-Aminobutyl)guanidine sulfate ; 1-Amino-4-guanidinobutane sulfate salt ; 4-Guanidinobutylamine sulfate salt . Agmatine sulfate (CAS NO.2482-00-0) is white to off-white powder.