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CAS No.: | 13031-60-2 |
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Name: | Methyl 4-aminobutyrate hydrochloride |
Article Data: | 44 |
Molecular Structure: | |
Formula: | C5H11NO2.HCl |
Molecular Weight: | 153.609 |
Synonyms: | Butanoic acid, 4-amino-, methyl ester, hydrochloride (1:1);4-methoxy-4-oxobutan-1-aminium chloride;4-Aminobutyric acid methyl ester hydrochloride; |
EINECS: | 629-526-4 |
Density: | 0.99g/cm3 |
Melting Point: | 120-125 °C |
Boiling Point: | 164.8 °C at 760 mmHg |
Flash Point: | 38.7 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37 |
PSA: | 52.32000 |
LogP: | 1.40060 |
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The Methyl 4-aminobutyrate hydrochloride with the cas number 13031-60-2, is also called 4-methoxy-4-oxobutan-1-aminium chloride .This chemical belongs to the following product categories:(1)Others; (2)Peptide Synthesis; (3)Unnatural Amino Acid Derivatives.When you are using this chemical, please be cautious about it as the following:(1)Irritating to eyes, respiratory system and skin; (2)In case of contact with eyes, rinse immediately with plenty of water and seek medical advice; (3)Wear suitable protective clothing and gloves.
The properties of the chemical are: (1)ACD/LogP: -0.18; (2)ACD/LogD (pH 5.5): -3.24; (3)ACD/LogD (pH 7.4): -2.39; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 26.3 Å2; (12)Enthalpy of Vaporization: 40.13 kJ/mol; (13)Vapour Pressure: 1.93 mmHg at 25°C.
The product can be supplied by the following suppliers:(1)J & K SCIENTIFIC LTD. ; (2)Wuhan Chemwish Technology Co., Ltd.; (3)Shanghai Sinch Parmaceuticals Tech. Co. Ltd.; (4)Shenyang Dakang Pharmaceutical Technology Co. Ltd.; (5)Atomax Chemicals Co., Ltd.; (6)PSN Chemical Technology Co., Ltd.; (7)Great Dragon Biochemicals Co., Ltd..
You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].O=C(OC)CCC[NH3+]
(2)InChI: InChI=1/C5H11NO2.ClH/c1-8-5(7)3-2-4-6;/h2-4,6H2,1H3;1H