Home > Compound List > Compound details
5835-28-9 molecular structure
click picture or here to close

2-[(2-hydroxyethyl)amino]acetic acid

ChemBase ID: 170566
Molecular Formular: C4H9NO3
Molecular Mass: 119.11916
Monoisotopic Mass: 119.05824315
SMILES and InChIs

SMILES:
OCCNCC(=O)O
Canonical SMILES:
OCCNCC(=O)O
InChI:
InChI=1S/C4H9NO3/c6-2-1-5-3-4(7)8/h5-6H,1-3H2,(H,7,8)
InChIKey:
FOUZISDNESEYLX-UHFFFAOYSA-N

Cite this record

CBID:170566 http://www.chembase.cn/molecule-170566.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-[(2-hydroxyethyl)amino]acetic acid
IUPAC Traditional name
[(2-hydroxyethyl)amino]acetic acid
Synonyms
2-[(2-hydroxyethyl)amino]acetic acid
N-(2-Hydroxyethyl)aminoacetic Acid
NSC 15828
Petalonine
N-(2-Hydroxyethyl)glycine (~90%)
CAS Number
5835-28-9
MDL Number
MFCD00082194
PubChem SID
164226476
PubChem CID
225935

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 225935 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 1.8229078  H Acceptors
H Donor LogD (pH = 5.5) -3.8762355 
LogD (pH = 7.4) -3.8776727  Log P -3.8762255 
Molar Refractivity 27.0703 cm3 Polarizability 10.868561 Å3
Polar Surface Area 69.56 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
Methanol expand Show data source
Water expand Show data source
Apperance
Off-White Solid expand Show data source
Melting Point
>140°C (dec.) expand Show data source
184 - 186°C expand Show data source
Hydrophobicity(logP)
-3.116 expand Show data source
Storage Condition
-20°C Freezer expand Show data source
MSDS Link
Download expand Show data source
Purity
95% expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle