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L(+)-2-Amino-4-bromobutyric acid hydrobromide

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Name

L(+)-2-Amino-4-bromobutyric acid hydrobromide

EINECS 626-083-9
CAS No. 15159-65-6 Density 1.71g/cm3
PSA 63.32000 LogP 1.84170
Solubility N/A Melting Point 189 °C (dec.)(lit.)
Formula C4H9Br2NO2 Boiling Point 294.5 °C at 760 mmHg
Molecular Weight 262.929 Flash Point 131.9 °C
Transport Information N/A Appearance white to light beige powder
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 15159-65-6 (L(+)-2-Amino-4-bromobutyric acid hydrobromide) Hazard Symbols IrritantXi
Synonyms

Butanoicacid, 2-amino-4-bromo-, hydrobromide, (2S)- (9CI);Butanoic acid,2-amino-4-bromo-, hydrobromide, (S)-;Butyric acid, 2-amino-4-bromo-,hydrobromide, L- (8CI);

Article Data 16

L(+)-2-Amino-4-bromobutyric acid hydrobromide Specification

This chemical is called Butanoic acid, 2-amino-4-bromo-, hydrobromide (1:1), (2S)-, and its CAS registry number is 15159-65-6. With the molecular formula of C4H9Br2NO2, its molecular weight is 262.93. Additionally, its product categories are Carboxylic Acids; Chiral Building Blocks; Organic Building Blocks.

Other characteristics of the Butanoic acid, 2-amino-4-bromo-, hydrobromide (1:1), (2S)- can be summarised as followings: (1)ACD/LogP: 0.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.05; (4)ACD/LogD (pH 7.4): -2.06; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 29.54 Å2; (13)Flash Point: 131.9 °C; (14)Enthalpy of Vaporization: 58.76 kJ/mol; (15)Boiling Point: 294.5 °C at 760 mmHg; (16)Vapour Pressure: 0.000395 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: Br.BrCC[C@H](N)C(=O)O
2.InChI: InChI=1/C4H8BrNO2.BrH/c5-2-1-3(6)4(7)8;/h3H,1-2,6H2,(H,7,8);1H/t3-;/m0./s1
3.InChIKey: JDLMXICGDYZOJH-DFWYDOINBC

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