β-Aminobutyric acid
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β-Aminobutyric acid
structure -
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CAS No:
541-48-0
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Formula:
C4H9NO2
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Chemical Name:
β-Aminobutyric acid
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Synonyms:
Butanoic acid,3-amino-;Butyric acid,3-amino-;Butyric acid,β-amino-;3-Aminobutanoic acid;β-Aminobutyric acid;β-Amino-n-butyric acid;3-Aminobutyric acid;β-Aminobutanoic acid;β-Methyl-β-alanine;Carbocreatine;3-Methyl-β-alanine;DL-3-Aminobutyric acid;DL-β-Aminobutyric acid;(±)-3-Aminobutanoic acid;(±)-β-Aminobutyric acid;DL-3-Aminobutanoic acid;(±)-3-Amino-n-butyric acid;(RS)-3-Aminobutanoic acid;(±)-3-Aminobutyric acid;NSC 77380;BABA;3-Azaniumylbutanoate;2835-82-7;167222-96-0
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CAS No:
Description
white powder
Solid
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 derives from a butyric acid. It is a conjugate acid of a 3-aminobutyrate. It is a tautomer of a 3-aminobutanoic acid zwitterion.
Characteristics
63.32000
-0.51
Solid
1.1±0.1 g/cm3
193 °C
223.6±23.0 °C at 760 mmHg
89.0±22.6 °C
1.462
H2O: almost transparency
Safety Information
NONH for all modes of transport
3
36/37/38
26
EK7713333
Xi
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
β-Aminobutyric acid Use and Manufacturing
3-Aminobutyric Acid is one of the three positional isomer of the the chemical compound butryric acid. 3-Aminobutyric Acid is a nonprotein amino acid. 3-Aminobutyric Acid has been shown to be a plant defense primer that suppresses growth of some insect herbivores when applied as a root drench.
Butanoic acid, 3-amino-: INACTIVE
Computed Properties
Molecular Weight:103.12
XLogP3:-3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:103.063328530
Monoisotopic Mass:103.063328530
Topological Polar Surface Area:63.3
Heavy Atom Count:7
Complexity:72.1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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