CAS 622-40-2|4-morpholineethanol|2-(morpholin-4-yl)ethan-1-ol|2-Morpholinoethanol|Morpholinoethanol|4-(2-HYDROXYETHYL)MORPHOLINE|2-吗啉乙醇|4-Morpholineethanol|NSC 1946|4-Morpholineethanol|2-(4-Morp...

General Information

Structure

Molecular Formula

C₆H₁₃NO₂

Molecular Mass

131.17292

Exact Mass

131.09462866

Charge

InChI

InChI=1S/C6H13NO2/c8-4-1-7-2-5-9-6-3-7/h8H,1-6H2

InChIKey

KKFDCBRMNNSAAW-UHFFFAOYSA-N

Canonic Smiles

OCCN1CCOCC1

Isomeric Smiles

C(CN1CCOCC1)O

Calculated Properties

JChem

LogD (pH = 7.4)

-0.93

LogD (pH = 5.5)

-2.41

Log P

-0.72

Rotatable Bonds

H Donor

H Acceptors

Lipinski's Rule of Five

true

Acid pKa

7.19

Polar Surface Area

32.70

Polarizability

14.13

Molar Refractivity

35.35

LOG S

0.84

Data Source

Names and Identifiers

IUPAC Traditional name

4-morpholineethanol 2-morpholinoethanol

IUPAC name

2-(morpholin-4-yl)ethan-1-ol

Synonyms

2-MorpholinoethanolMorpholinoethanol4-(2-HYDROXYETHYL)MORPHOLINE2-吗啉乙醇4-MorpholineethanolNSC 19464-Morpholineethanol2-(4-Morpholinyl)-1-ethanol4-(2-羟乙基)吗啉4-(2-Hydroxyethyl)morpholine2-Morpholinoethanol4-羟乙基吗啉N-(2-Hydroxyethyl)morpholine2-(4-Morpholino)ethyl Alcohol2-(4-Morpholinyl)ethanolβ-Morpholinoethanol4-(2-Hydroxyethyl)morpholineN-(β-Hydroxyethyl)morpholine4-2-羟乙基吗啉hydroxyethylmorpholinemorpholine ethanol4-(2-hydroxyethyl)morpholine2-(4-morpholinyl)ethanolN(2-hydroxyethyl)morpholine2-(morpholin-4-yl)ethanolN-beta-hydroxyethylmorpholine4-morpholineethanol

Names and Identifiers

Registration numbers

CAS Number

EC Number

MDL Number

Beilstein Number

PubChem SID

2487829216203619824895537160645520

PubChem CID

Reaxys Registry

BindingDB Database

BKMS React Database

CHEBI ID

ACToR Database

MetaboLights Database

MTBLS1693MTBLS2145MTBLS1622

BRENDA Ligand Database

CompTox Database

NMRShiftDB Database

SureChEMBL Database

BRENDA Database

CHEMBL

Registration numbers

Properties

Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

MP Biomedicals

02157445

1 ml = approx. 1.08 g

Sigma Aldrich

H28203

Packaging
5, 100, 250 g in glass bottle
Legal Information
ReagentPlus is a registered trademark of Sigma-Aldrich Co. LLC

54409

Other Notes
Gel buffer component in gel electrophoresis of polystyrene particles in glutaraldehyde cross-linked polyvinyl alcohol1

TRC

M723750

4-(2-Hydroxyethyl)morpholine is a morphiline derivative used in the preparation of ester prodrugs of naproxen. 4-(2-Hydroxyethyl)morpholine was also shown to induce repair in rat hepatocyte primary culture/DNA.

ChEBI

CHEBI:67144

A primary alcohol that is ethanol in which one of the methyl hydrogens is replaced by a morpholin-4-yl group.

Molecule Details

References

PubChem Literature

From Data Sources

• Tsai, S.-W. et al.: Chem. Technol. Biotechnol., 74, 751 (1984)

• Conaway, C.C. et al.: Mutat. Res. Gen. Toxicol. Test., 136, 153 (1984)

References

Bioactivity

PubChem BioAssay