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ChemicalBook--->CAS DataBase List--->2835-82-7

2835-82-7

2835-82-7 Structure

2835-82-7 Structure
IdentificationMore
[Name]

DL-3-Aminobutyric acid
[CAS]

2835-82-7
[Synonyms]

3-AMINOBUTANOIC ACID
3-AMINOBUTYLIC ACID
3-AMINOBUTYRIC ACID
AMINOBUTYRIC ACID, 3-
BETA-AMINOBUTYRIC ACID
DL-3-AMINOBUTANOIC ACID
DL-3-AMINOBUTYRIC ACID
DL-3-AMINO-N-BUTYRIC ACID
DL-BETA-AMINOBUTYRIC ACID
DL-BETA-AMINO-N-BUTYRIC ACID
H-DL-ABU(3)-OH
H-DL-ABU(BETA)-OH
H-DL-BETA-ABU-OH
RARECHEM AK HD C012
DL-3-AMINO-N-BUTYRIC ACID (BETA-)
DL-BETA-AMINOBUTYRIC ACID DL-3-AMINOBUTYRIC ACID
DL-α-Aminobutanoicacid
DL-beta-homo-alanine
3-Methyl-b-alanine
DL-BABA
[EINECS(EC#)]

220-617-0
[Molecular Formula]

C4H9NO2
[MDL Number]

MFCD00008087
[Molecular Weight]

103.12
[MOL File]

2835-82-7.mol
Chemical PropertiesBack Directory
[Melting point ]

189 °C (dec.)(lit.)
[alpha ]

[α]D20 0.0±0.1° (c=2, H2O)
[density ]

1.2300 (estimate)
[refractive index ]

1.4650 (estimate)
[solubility ]

soluble
[pka]

pK2: 10.14(0) (25°C)
[Water Solubility ]

soluble
[CAS DataBase Reference]

2835-82-7(CAS DataBase Reference)
[EPA Substance Registry System]

2835-82-7(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S24/25:Avoid contact with skin and eyes .
S22:Do not breathe dust .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[RTECS ]

EK7713333
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

DL-3-Aminobutyric acid(2835-82-7).msds
Hazard InformationBack Directory
[Definition]

ChEBI: 3-aminobutanoic acid is a beta-amino acid that is butyric acid which is substituted by an amino group at position 3. It has a role as a metabolite. It is a beta-amino acid and a monocarboxylic acid. It is functionally related to a butyric acid. It is a conjugate acid of a 3-aminobutyrate. It is a tautomer of a 3-aminobutanoic acid zwitterion.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 23, p. 94, 1958 DOI: 10.1021/jo01095a604
[Purification Methods]

Crystallise the acid from aqueous EtOH or MeOH/Et2O. Also crystallise it by heating a slightly diluted EtOH solution and adding Me2CO. It gives a purple spot with RF 0.89 on paper chromatography using 80% aqueous phenol (the -amino acid has RF 0.74). [Zilka & Rivlin J Org Chem 23 94 1958, Bruylants Bull Soc Chim Belg 32 259 1923, Beilstein 4 IV 2595.]
Spectrum DetailBack Directory
[Spectrum Detail]

DL-3-Aminobutyric acid(2835-82-7)MS
DL-3-Aminobutyric acid(2835-82-7)1HNMR
DL-3-Aminobutyric acid(2835-82-7)13CNMR
DL-3-Aminobutyric acid(2835-82-7)IR1
DL-3-Aminobutyric acid(2835-82-7)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

DL-3-Amino-n-butyric acid, 97%(2835-82-7)
[Sigma Aldrich]

2835-82-7(sigmaaldrich)
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