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2-Amino-4-(2-aminoethoxy)butanoic acid

HCID 83228
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Basic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
504-91-6
Standard SMILES
NCC(O)CC[C@H](N)C(=O)O
InChIKey
FDDYPVBIHWFLOI-UHFFFAOYSA-N
Molecular formula
C6H14N2O3
Average molar mass
162.19 g/mol
Monoisotopic mass
162.10044231

Overview

RN given refers to cpd without isomeric designation; structure

Names & identifiers

Preferred name
2-Amino-4-(2-aminoethoxy)butanoic acid
IUPAC
(2S)-2,6-diamino-5-hydroxyhexanoic acid
English name
2-amino-4-(2-aminoethoxy)butanoic acid
Molecular weight
0

Names & synonyms

504-91-62-Aae-BAHomoserine, O-(2-aminoethyl)-RefChem:851722-Amino-4-(2-aminoethoxy)butanoic acidDL-D-Hydroxylysine(2S)-2,6-diamino-5-hydroxyhexanoic acid906331-35-9hydroxylysin5-hydroxy-l-lys78088-29-6SCHEMBL29199
Show more names
2,6-Diamino-5-hydroxyhexanoic acid
L-alpha-(2-Aminoethoxyvinyl)glycineMFCD19237312L-2-Amino-4-(2-aminoethoxy)butanoic acidNS00014755D792EAEA-B449-4A45-A44B-278EF2A12CEB

Database identifiers

CAS
504-91-6
PubChem CID
83228
Nikkaji
J147.233J

Properties

Computed structural properties

XLogP
-4.2
Topological polar surface area
110 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
11
Formal charge
0
Complexity
129

Physicochemical properties

Boiling point
288.88 °C · 288.88°C (rough estimate)
Density
1.2266 · 1.2266 (rough estimate)
refractive index
1.465 · 1.4650 (estimate)

Related reactions

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Compound notes

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