2,3-Diaminopropionic acid
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2,3-Diaminopropionic acid
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CAS No:
515-94-6
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Formula:
C3H8N2O2
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Chemical Name:
2,3-Diaminopropionic acid
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Synonyms:
Alanine,3-amino-;Propionic acid,2,3-diamino-;3-Aminoalanine;2,3-Diaminopropanoic acid;α,β-Diaminopropionic acid;2,3-Diaminopropionic acid;β-Alanine,2-amino-;β-Aminoalanine;Propanoic acid,2,3-diamino-;2-Amino-β-alanine;DL-α,β-Diaminopropionic acid;DL-2,3-Diaminopropanoic acid;DL-3-Aminoalanine;(RS)-2,3-Diaminopropionic acid;(±)-2,3-Diaminopropionic acid;DL-2,3-Diaminopropionic acid;3-Amino-DL-alanine;6018-54-8
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CAS No:
Description
ChEBI: A diamino acid that is alanine in which one of the hydrogens of the methyl group is replaced by an amino group.
3-aminoalanine is a diamino acid that is alanine in which one of the hydrogens of the methyl group is replaced by an amino group. It has a role as an Escherichia coli metabolite. It is a diamino acid, a beta-amino acid, a non-proteinogenic alpha-amino acid and an alanine derivative. It derives from a propionic acid. It is a conjugate acid of a 3-aminoalaninate. It is a tautomer of a 3-aminoalanine zwitterion.
Characteristics
89.34000
-4.3
1.294 g/cm3
243-245 °C (decomp)
325.6ºC at 760 mmHg
150.7ºC
138.1 Ų [M+H]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|118.2 Ų [M-H]- [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]
Computed Properties
Molecular Weight:104.11
XLogP3:-4.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:104.058577502
Monoisotopic Mass:104.058577502
Topological Polar Surface Area:89.3
Heavy Atom Count:7
Complexity:73.3
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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