4-Acetamidobutanoic acid

Names

[ Name ]:
4-Acetamidobutanoic acid

[Synonym ]:
4-acetamidobutyrate
N-Acetyl-4-aminobutyric acid
N-Acetyl-4-aminobutanoic acid
EINECS 221-186-1
N4-Acetylaminobutanoate
BUTYRIC ACID,4-ACETAMIDO
4-Acetamidobutyric acid
MFCD00020552

Biological Activity

[Description]:

4-Acetamidobutanoic acid (N-acetyl GABA) is a γ-aminobutyric acid (GABA) derivative.

[Related Catalog]:

Signaling Pathways >> Membrane Transporter/Ion Channel >> GABA Receptor

Signaling Pathways >> Neuronal Signaling >> GABA Receptor

Natural Products >> Others

Research Areas >> Others

[Target]

Human Endogenous Metabolite

[Related Small Molecules]

Chemical & Physical Properties

[ Density]:
1.133 g/cm3

[ Boiling Point ]:
405.4ºC at 760 mmHg

[ Melting Point ]:
128-131 °C

[ Molecular Formula ]:
C₆H₁₁NO₃

[ Molecular Weight ]:
145.15600

[ Flash Point ]:
199ºC

[ Exact Mass ]:
145.07400

[ PSA ]:
66.40000

[ LogP ]:
0.37820

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: ES5610000

CHEMICAL NAME :: Butyric acid, 4-acetamido-

CAS REGISTRY NUMBER :: 3025-96-5

BEILSTEIN REFERENCE NO. :: 1762288

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C6-H11-N-O3

MOLECULAR WEIGHT :: 145.18

WISWESSER LINE NOTATION :: QV3MV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 425 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 145,233,1963 ** REPRODUCTIVE DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Subcutaneous

DOSE :: 105 mg/kg

SEX/DURATION :: male 21 day(s) pre-mating

TOXIC EFFECTS :: Reproductive - Paternal Effects - testes, epididymis, sperm duct

REFERENCE :: ARANDR Archives of Andrology. (Elsevier Science Pub. Co., Inc., 52 Vanderbilt Ave., New York, NY 10017) V.1- 1978- Volume(issue)/page/year: 10,239,1983

Safety Information

[ Hazard Codes ]:
Xi:Irritant;

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S37/39-S26

[ RTECS ]:
ES5610000

[ HS Code ]:
2924199090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 2924199090

[ Summary ]:
2924199090. other acyclic amides (including acyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%