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13031-60-2

13031-60-2 structure
13031-60-2 structure
  • Name: H-GABA-Ome.HCl
  • Chemical Name: Methyl 4-aminobutyrate hydrochloride
  • CAS Number: 13031-60-2
  • Molecular Formula: C5H12ClNO2
  • Molecular Weight: 153.61
  • Catalog: Biochemical Amino acids and their derivatives Amino acid salt
  • Create Date: 2018-10-01 22:07:15
  • Modify Date: 2024-01-02 00:57:11
  • Methyl 4-aminobutyrate HCl is a biochemical reagent that can be used as a biological material or organic compound for life science related research.

Name Methyl 4-aminobutyrate hydrochloride
Synonyms 4-Methoxy-4-oxo-1-butanaminium chloride
methyl 4-aminobutanoate,hydrochloride
Methyl 4-Aminobutyrate Hydrochloride
Butanoic acid, 4-amino-, methyl ester, hydrochloride (1:1)
MFCD00043270
Methyl 4-aminobutanoate hydrochloride
H-GABA-Ome.HCl
Description Methyl 4-aminobutyrate HCl is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Related Catalog
In Vitro Methyl 4-aminobutanoate (hydrochloride) 是由氨基丁酸和甲醇缩合而成的甲酯化合物。
Density 0.99g/cm3
Boiling Point 164.8ºC at 760mmHg
Melting Point 120-125ºC
Molecular Formula C5H12ClNO2
Molecular Weight 153.61
Flash Point 38.7ºC
Exact Mass 153.055649
PSA 52.32000
LogP 1.40060
Vapour Pressure 1.93mmHg at 25°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ES7065000
CHEMICAL NAME :
Butyric acid, 4-amino-, methyl ester, hydrochloride
CAS REGISTRY NUMBER :
13031-60-2
LAST UPDATED :
198806
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C5-H11-N-O2.Cl-H
MOLECULAR WEIGHT :
153.63

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
950 mg/kg
TOXIC EFFECTS :
Behavioral - anticonvulsant Behavioral - somnolence (general depressed activity)
REFERENCE :
BCPCA6 Biochemical Pharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1958- Volume(issue)/page/year: 32,1093,1983
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1300 mg/kg
TOXIC EFFECTS :
Behavioral - anticonvulsant Behavioral - somnolence (general depressed activity)
REFERENCE :
BCPCA6 Biochemical Pharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1958- Volume(issue)/page/year: 32,1093,1983
Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xi: Irritant;
Risk Phrases R36/37/38
Safety Phrases 26-36/37
RIDADR NONH for all modes of transport
WGK Germany 3
RTECS ES7065000
HS Code 2922499990

~91%

13031-60-2 structure

13031-60-2

Literature: Weitman, Michal; Lerman, Keti; Nudelman, Abraham; Major, Dan Thomas; Hizi, Amnon; Herschhorn, Alon European Journal of Medicinal Chemistry, 2011 , vol. 46, # 2 p. 447 - 467

~98%

13031-60-2 structure

13031-60-2

Literature: Fakova, Helena; Pour, Milan; Kunes, Jiri; Senel, Petr Tetrahedron Letters, 2005 , vol. 46, # 47 p. 8137 - 8140

~99%

13031-60-2 structure

13031-60-2

Literature: Mandal, Pijus K.; McMurray, John S. Journal of Organic Chemistry, 2007 , vol. 72, # 17 p. 6599 - 6601

~%

13031-60-2 structure

13031-60-2

Literature: US5354753 A1, ;

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13031-60-2 structure

13031-60-2

Literature: WO2008/40000 A2, ; Page/Page column 57 ;

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13031-60-2 structure

13031-60-2

Literature: Journal of the Chemical Society, Chemical Communications, , # 16 p. 1095 - 1096
HS Code 2922499990
Summary HS:2922499990 other amino-acids, other than those containing more than one kind of oxygen function, and their esters; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0%