Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

4-Acetamidobutyric acid

Related Products

Hot Products

Name

4-Acetamidobutyric acid

EINECS 221-186-1
CAS No. 3025-96-5 Density 1.133 g/cm3
PSA 66.40000 LogP 0.37820
Solubility Soluble in water (19.9 mg/ml). Melting Point 128-131 °C
Formula C6H11NO3 Boiling Point 405.399 °C at 760 mmHg
Molecular Weight 145.158 Flash Point 198.979 °C
Transport Information N/A Appearance light yellow to beige crystalline powder
Safety 37/39-26 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 3025-96-5 (4-ACETAMIDOBUTYRIC ACID) Hazard Symbols IrritantXi
Synonyms

N-Acetyl-4-aminobutyric acid;N-Acetyl-4-aminobutanoicacid;4-Acetylaminobutyric acid;N-Acetyl-γ-aminobutyric acid;NSC 27423;4-(Acetylamino)butanoic acid;Butyricacid, 4-acetamido- (6CI,7CI,8CI);

Article Data 13

4-Acetamidobutyric acid Synthetic route

108-24-7

acetic anhydride

56-12-2

4-amino-n-butyric acid

3025-96-5

N-Acetyl-4-aminobutyric acid

Conditions
ConditionsYield
With acetic acid In diethyl ether for 1h; Reflux; Inert atmosphere;97%
In diethyl ether; acetic acid for 1h; Inert atmosphere;95%
In methanol for 6h; Reflux;75%
934-87-2

S-phenyl thioacetate

56-12-2

4-amino-n-butyric acid

3025-96-5

N-Acetyl-4-aminobutyric acid

Conditions
ConditionsYield
With ethanol
34456-78-5

1-acetylpiperidin-3-one

3025-96-5

N-Acetyl-4-aminobutyric acid

Conditions
ConditionsYield
With oxygen
692-33-1

N-allylacetamide

201230-82-2

carbon monoxide

A

60-35-5

acetamide

B

3025-96-5

N-Acetyl-4-aminobutyric acid

C

13862-98-1

N-acetyl-3-amino-2-methylpropanoic acid

D

123-38-6

propionaldehyde

Conditions
ConditionsYield
With trisodium tris(3-sulfophenyl)phosphine; water; toluene-4-sulfonic acid; palladium dichloride at 60℃; under 37503 Torr; for 24h; Further byproducts given;A n/a
B 43.6 % Chromat.
C 11.5 % Chromat.
D n/a
With trisodium tris(3-sulfophenyl)phosphine; water; toluene-4-sulfonic acid; palladium dichloride at 60℃; under 7500.6 Torr; for 12h; Further byproducts given;A n/a
B 61.7 % Chromat.
C 3.6 % Chromat.
D n/a
75-36-5

acetyl chloride

56-12-2

4-amino-n-butyric acid

3025-96-5

N-Acetyl-4-aminobutyric acid

Conditions
ConditionsYield
With triethylamine In methanol
50-00-0

formaldehyd

3025-96-5

N-Acetyl-4-aminobutyric acid

10239-34-6

N,N'-dibenzyl-1,3-diaminopropane

59795-89-0

phenethyl isocyanide

1061274-71-2

4-(acetylamino)-N-benzyl-N-(3-{benzyl[2-oxo-2-(phenethylamino)ethyl]amino}propyl)butanamide

Conditions
ConditionsYield
In methanol for 16h; Ugi condensation; Reflux;85%
672-13-9

2-hydroxy-5-methoxybenzaldehyde

3025-96-5

N-Acetyl-4-aminobutyric acid

2-formyl-4-methoxyphenyl-4-acetamidobutanoate

Conditions
ConditionsYield
With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine In dichloromethane at 20℃; for 5h;76%
50-00-0

formaldehyd

3025-96-5

N-Acetyl-4-aminobutyric acid

2769-64-4

n-butyl isonitrile

10239-34-6

N,N'-dibenzyl-1,3-diaminopropane

1061274-66-5

4-(acetylamino)-N-benzyl-N-(3-{benzyl[2-(butylamino)-2-oxoethyl]amino}propyl)butanamide

Conditions
ConditionsYield
In methanol for 16h; Ugi condensation; Reflux;74%
3025-96-5

N-Acetyl-4-aminobutyric acid

64-04-0

phenethylamine

1552271-66-5

4-acetamido-N-phenethylbutanamide

Conditions
ConditionsYield
Stage #1: N-Acetyl-4-aminobutyric acid With triethylamine In dichloromethane at 0℃; for 0.5h; Inert atmosphere;
Stage #2: phenethylamine With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride In dichloromethane at 0 - 20℃; Inert atmosphere;
73%
167308-64-7

3-{[(R)-2,2,5,5-tetramethyl-1,3-dioxan-4-yl]carbonylamino}-1-(2-mercaptoethylamino)-1-propanone

3025-96-5

N-Acetyl-4-aminobutyric acid

N-[2-[(4-acetamidobutanoyl)sulfanyl]ethyl]-3-[[(4R)-2,2,5,5-tetramethyl-1,3-dioxan-4-yl]formamido]propanamide

Conditions
ConditionsYield
With 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine In dichloromethane at 25℃; for 16h; Inert atmosphere;71%

4-Acetamidobutyric acid Specification

The 4-Acetamidobutyric acid, with the CAS registry number 3025-96-5, is also known as N-Acetyl-γ-aminobutyric acid. It belongs to the product categories of Amino Acids; Aliphatics; Carboxylic Acids. Its EINECS number is 221-186-1. This chemical's molecular formula is C6H11NO3 and molecular weight is 145.16. What's more, its systematic name is 4-Acetamidobutanoic acid. Its classification code is Reproductive Effect.

Physical properties of 4-Acetamidobutyric acid are: (1)ACD/LogP: -0.962; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.91; (4)ACD/LogD (pH 7.4): -3.72; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 66.4 Å2; (13)Index of Refraction: 1.459; (14)Molar Refractivity: 35.035 cm3; (15)Molar Volume: 128.138 cm3; (16)Polarizability: 13.889×10-24cm3; (17)Surface Tension: 41.7 dyne/cm; (18)Density: 1.133 g/cm3; (19)Flash Point: 198.979 °C; (20)Enthalpy of Vaporization: 72.09 kJ/mol; (21)Boiling Point: 405.399 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

When you are using 4-Acetamidobutyric acid, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(NCCCC(=O)O)C;
(2)Std. InChI: InChI=1S/C6H11NO3/c1-5(8)7-4-2-3-6(9)10/h2-4H2,1H3,(H,7,8)(H,9,10);
(3)Std. InChIKey: UZTFMUBKZQVKLK-UHFFFAOYSA-N;

The toxicity data of 4-Acetamidobutyric acid as follows: 

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 425mg/kg (425mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 145, Pg. 233, 1963.

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 3025-96-5