2-Aminomalonamide supplier | CasNO.62009-47-6

Name
2-aminopropanediamide
EINECS 263-370-4
CAS No. 62009-47-6
Article Data19
CAS DataBase
Density 1.399 g/cm³
Solubility
Melting Point 180-185°C
Formula C₃H₇N₃O₂
Boiling Point 410.1 °C at 760 mmHg
Molecular Weight 117.107
Flash Point 201.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Aminopropanediamide;
PSA 112.20000
LogP -0.61480

Synthetic route

: 6829-40-9
aminomalonic acid diethyl ester

: 62009-47-6
2-aminopropanediamide

Conditions

Conditions	Yield
With ammonia In methanol at 80℃;	100%
With ammonium chloride In water at 100℃; for 2h;	87%
With ammonia In methanol at 60℃; for 19h; Product distribution / selectivity; Inert atmosphere;	49%
With ethanol; ammonia

: 13433-00-6
diethyl aminomalonate hydrochloride

: 62009-47-6
2-aminopropanediamide

Conditions

Conditions	Yield
With ammonia In methanol at 20℃; for 20h; Autoclave;	95%
With ammonia In methanol for 1h;	91%
Stage #1: diethyl aminomalonate hydrochloride With sodium hydrogencarbonate In water pH=> 7; Stage #2: With ammonia In methanol at 80℃; High pressure;	73%

: 14064-10-9
diethyl 2-chloromalonate

: 62009-47-6
2-aminopropanediamide

Conditions

Conditions	Yield
With ethanol; ammonia

: 69645-51-8
2-nitromalonamide

: 62009-47-6
2-aminopropanediamide

Conditions

Conditions	Yield
With aluminium amalgam; ammonia

: 14064-10-9
diethyl 2-chloromalonate

: 7664-41-7
ammonia

: 62009-47-6
2-aminopropanediamide

aminomalonic acid ester hydrochloride: aminomalonic acid ester hydrochloride

: 62009-47-6
2-aminopropanediamide

Conditions

Conditions	Yield
With ammonia; water

isonitrosomalonamide: isonitrosomalonamide

: 62009-47-6
2-aminopropanediamide

Conditions

Conditions	Yield
With hydrogen iodide durch Reduktion;

: 62009-47-6
2-aminopropanediamide

: 24424-99-5
di-tert-butyl dicarbonate

: C8H15N3O4

Conditions

Conditions	Yield
Stage #1: 2-aminopropanediamide; di-tert-butyl dicarbonate In methanol at 0 - 4℃; for 1h; Stage #2: With triethylamine In methanol at 22 - 27℃; for 18h; pH=10-12;	94.78%

: 131543-46-9
Glyoxal

: 62009-47-6
2-aminopropanediamide

: 1237524-82-1
sodium 2-carbamoylpyrazine-3-hydroxylate

Conditions

Conditions	Yield
With sodium hydroxide In water at -10 - 22℃; for 4.66667h;	92%
With lithium chloride; sodium hydroxide at 20℃; for 3.5h; Temperature;	88.2%

: 131543-46-9
Glyoxal

: 62009-47-6
2-aminopropanediamide

: 55321-99-8
2-hydroxypyrazine-3-carboxamide

Conditions

Conditions	Yield
With sodium hydroxide In water at -10 - 22℃; for 4.67h;	91.2%
Stage #1: Glyoxal; 2-aminopropanediamide In water at 90℃; for 3h; Stage #2: With ammonia; dihydrogen peroxide In water at 0 - 20℃;	63%
With phosphoric acid; sodium hydroxide In water at 20 - 30℃; for 1.5h;	118 g
With phosphoric acid; sodium hydroxide In aq. phosphate buffer; water at 20 - 30℃; for 1.5h;	118 mg

: ethyl 2-(4-nitrobenzoyl)-3-dimethylaminopropenoate

: 62009-47-6
2-aminopropanediamide

: 939807-27-9
ethyl 5-(aminocarbonyl)-4-(4-nitrophenyl)-1H-pyrrole-3-carboxylate

Conditions

Conditions	Yield
With trifluoroacetic acid In acetic acid at 80℃;	83.7%

: 62009-47-6
2-aminopropanediamide

: 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboximidamide hydrochloride

: 428854-24-4
2-(1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl)pyrimidine-4,5,6- triamine

Conditions

Conditions	Yield
Stage #1: 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboximidamide hydrochloride With sodium methylate In methanol Reflux; Stage #2: 2-aminopropanediamide In methanol at 65℃; for 2.5h; Temperature; Concentration; Reflux;	83%

: 62009-47-6
2-aminopropanediamide

: 78-98-8
2-oxopropanal

: 88394-05-2
3-carboxamido-2-hydroxy-6-methylpyrazine

Conditions

Conditions	Yield
With sodium hydroxide In water at 5℃; for 6h; Temperature;	78%
Stage #1: 2-oxopropanal With sodium hydrogensulfite; sodium hydroxide In water at 80℃; for 1h; Stage #2: 2-aminopropanediamide In water at 80℃; for 2h; Stage #3: With dihydrogen peroxide; sodium acetate In water at 20 - 65℃; for 1h;	61%
With sodium hydroxide monohydrate at 6℃; for 4h; Temperature;

: 62009-47-6
2-aminopropanediamide

: 27913-51-5
1-phenyl-propane-1,2-dione-1-phenylhydrazone

: 4-methyl-5-phenyl-1H-imidazole-2-carboxamide

Conditions

Conditions	Yield
for 72h; Heating;	77%

: 62009-47-6
2-aminopropanediamide

: 939807-29-1
ethyl 2-(3-fluoro-4-nitrobenzoyl)-3-(dimethylamino)acrylate

: 939807-30-4
ethyl 5-(aminocarbonyl)-4-(3-fluoro-4-nitrophenyl)-1H-pyrrole-3-carboxylate

Conditions

Conditions	Yield
Stage #1: 2-aminopropanediamide; ethyl 2-(3-fluoro-4-nitrobenzoyl)-3-(dimethylamino)acrylate In acetic acid at 80℃; for 2h; Stage #2: With trifluoroacetic acid at 60℃; for 4h;	76%

: 62009-47-6
2-aminopropanediamide

: 1-phenylhydrazono-1-(4-pyridinyl)-2-propanone

: 4-methyl-5-(4-pyridinyl)-1H-imidazole-2-carboxamide

Conditions

Conditions	Yield
In various solvent(s) for 72h; Mechanism; Heating; other 1,2-diketone monophenylhydrazones;	74%
for 72h; Heating;	74%

: ethyl iminoethoxycarbonylacetate hydrochloride

: 62009-47-6
2-aminopropanediamide

: ethyl 4-carbamoyl-5-hydroxy-1H-imidazole-2-acetate

Conditions

Conditions	Yield
In methanol	72.7%

: 62009-47-6
2-aminopropanediamide

: 6630-86-0
benzil phenylhydrazone

: 41270-78-4
4,5-diphenyl-1H-imidazole-2-carboxamide

Conditions

Conditions	Yield
for 72h; Heating;	71%

: 72727-87-8
Ethyl imino α-carbamoylacetate hydrochloride

: 62009-47-6
2-aminopropanediamide

: 4-carbamoyl-5-hydroxy-1H-imidazole-2-acetamide

Conditions

Conditions	Yield
In methanol	70.3%

: ethyl 2-(3-fluoro-4-nitrobenzoyl)-3-(dimethylamino)acrylate

: 62009-47-6
2-aminopropanediamide

: 939807-30-4
ethyl 5-(aminocarbonyl)-4-(3-fluoro-4-nitrophenyl)-1H-pyrrole-3-carboxylate

Conditions

Conditions	Yield
In acetic acid at 80℃;	69%

: 131543-46-9
Glyoxal

: 62009-47-6
2-aminopropanediamide

: 55321-99-8
3-oxo-3,4-dihydropyrazine-2-carboxamide

Conditions

Conditions	Yield
Stage #1: Glyoxal; 2-aminopropanediamide In water at 90℃; for 3h; Inert atmosphere; Stage #2: With ammonium hydroxide; dihydrogen peroxide In water at 20℃; for 1h; pH=7; Inert atmosphere;	63%

: 62009-47-6
2-aminopropanediamide

: 431-03-8
dimethylglyoxal

: 90000-71-8
5,6-dimethyl-3-oxo-3,4-dihydropyrazine-2-carboxamide

Conditions

Conditions	Yield
With water; sodium hydroxide at 10℃; for 0.333333h;	51%
With sodium hydroxide
With acetic acid; sodium hydroxide In water at 10℃; for 2.33333h; pH=6;	13.00 g

: 62009-47-6
2-aminopropanediamide

: 5335-28-4
phenyl-glyoxal-2-phenylhydrazone

: 41270-75-1
4-phenyl-1H-imidazole-2-carboxamide

Conditions

Conditions	Yield
for 72h; Heating;	51%

: 62009-47-6
2-aminopropanediamide

: 13732-32-6
biacetyl phenylhydrazone

: 4,5-dimethyl-1H-imidazole-2-carboxamide

Conditions

Conditions	Yield
for 72h; Heating;	46%

: 62009-47-6
2-aminopropanediamide

: 5391-74-2
1-(phenylhydrazono)-propan-2-one

: 4-methyl-1H-imidazole-2-carboxamide

Conditions

Conditions	Yield
for 72h; Heating;	42%

: 62009-47-6
2-aminopropanediamide

: 78-98-8
2-oxopropanal

: 88394-05-2
5-methyl-3-oxo-3,4-dihydropyrazine-2-carboxamide

Conditions

Conditions	Yield
Stage #1: 2-oxopropanal With sodium hydrogensulfite; sodium hydroxide In water at 80℃; for 1h; Stage #2: 2-aminopropanediamide In water at 80℃; for 2h; Stage #3: With dihydrogen peroxide; sodium acetate In water at 20 - 65℃;	36%
With sodium hydroxide

: 62009-47-6
2-aminopropanediamide

: 78-98-8
2-oxopropanal

: 88394-06-3
6-methyl-3-oxo-3,4-dihydro-pyrazine-2-carboxylic acid amide

Conditions

Conditions	Yield
Stage #1: 2-aminopropanediamide; 2-oxopropanal With sodium hydroxide In water at -20 - 20℃; Stage #2: With hydrogenchloride In water at -20 - 20℃; for 48h;	28%

: 617-35-6
2-oxo-propionic acid ethyl ester

: 62009-47-6
2-aminopropanediamide

: 6-methyl-3,5-dioxo-2,3,4,5-tetrahydro-pyrazine-2-carboxylic acid amide

Conditions

Conditions	Yield
With sodium methylate

: 79-43-6
dichloro-acetic acid

: 62009-47-6
2-aminopropanediamide

: 98022-03-8
(2,2-dichloro-acetylamino)-malonic acid diamide

: 64-18-6
formic acid

: 62009-47-6
2-aminopropanediamide

: 10265-51-7
formylamino-malonic acid diamide

Conditions

Conditions	Yield
at 100℃;

: 44234-35-7
formimidic acid ethyl ester

: 62009-47-6
2-aminopropanediamide

: 68543-34-0
5-oxo-4,5-dihydro-1H-imidazole-4-carboxylic acid amide

Conditions

Conditions	Yield
With hydrogenchloride

: 6322-61-8
N-acetyldithiocarbamic acid ethyl ester

: 62009-47-6
2-aminopropanediamide

: (N'-acetyl-thioureido)-malonic acid diamide

Conditions

Conditions	Yield
With ethanol

: 62009-47-6
2-aminopropanediamide

: 1074-12-0
phenylglyoxal hydrate

: 67602-11-3
3-oxo-6-phenyl-3,4-dihydro-pyrazine-2-carboxylic acid amide

Conditions

Conditions	Yield
With sodium hydroxide

: 62009-47-6
2-aminopropanediamide

: 6958-78-7
O-ethyl N-benzoylthiocarbamidate

: (O-ethyl-N'-benzoyl-isoureido)-malonic acid diamide

Conditions

Conditions	Yield
With ethanol at 100℃;

2-Aminomalonamide Specification

The Propanediamide, 2-amino-, with the CAS registry number of 62009-47-6, is also known as 2-Azanylpropanediamide. Its EINECS registry number is 263-370-4. This chemical's molecular formula is C₃H₇N₃O₂ and molecular weight is 117.10658. What's more, its IUPAC name is 2-Aminopropanediamide.

Physical properties about Propanediamide, 2-amino- are: (1)ACD/LogP: -2.26; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -2.34; (4)ACD/LogD (pH 7.4): -2.26; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.15; (8)ACD/KOC (pH 7.4): 1.41; (9)#H bond acceptors: 5; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 43.86 Å²; (13)Index of Refraction: 1.547; (14)Molar Refractivity: 26.57 cm³; (15)Molar Volume: 83.7 cm³; (16)Polarizability: 10.53×10^-24 cm³; (17)Surface Tension: 74.7 dyne/cm; (18)Density: 1.399 g/cm³; (19)Flash Point: 201.8 °C; (20)Enthalpy of Vaporization: 66.23 kJ/mol; (21)Boiling Point: 410.1 °C at 760 mmHg; (22)Vapour Pressure: 6.19E-07 mmHg at 25 °C.

Uses: it can be used as reagent used in the synthesis of Imidazole derivatives. For example, it is used to produce 4, 5-Dimethyl-1H-imidazole-2-carboxamide at heating. The reaction time is 72 hours. The yield is about 46 %.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N)C(N)C(=O)N
(2) InChI: InChI=1/C3H7N3O2/c4-1(2(5)7)3(6)8/h1H,4H2,(H2,5,7)(H2,6,8)
(3) InChIKey: GFQBSQXXHYLABK-UHFFFAOYAM

Product Name

2-aminopropanediamide

Synthetic route

2-Aminomalonamide Specification

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