CAS 150-25-4|N,N-bis [2-hydroxyethyl]glycine|Bicine|2-[bis(2-hydroxyethyl)amino]acetic acid|bicine|DIHYDROXYETHYLGLYCINE|N,N-双(2-羟乙基)甘氨酸|BICINE|Dihydroxyethylglycine|<i>N</i>,<i>N</i>-Bis(2-h...

General Information

Structure

Molecular Formula

C₆H₁₃NO₄

Molecular Mass

163.17172

Exact Mass

163.0844579

Charge

InChI

InChI=1S/C6H13NO4/c8-3-1-7(2-4-9)5-6(10)11/h8-9H,1-5H2,(H,10,11)

InChIKey

FSVCELGFZIQNCK-UHFFFAOYSA-N

Canonic Smiles

OCCN(CC(=O)O)CCO

Isomeric Smiles

OCCN(CCO)CC(=O)O

Calculated Properties

JChem

LogD (pH = 7.4)

-4.69

LogD (pH = 5.5)

-3.88

Log P

-3.85

Rotatable Bonds

H Donor

H Acceptors

Lipinski's Rule of Five

true

Acid pKa

3.00

Polar Surface Area

81.00

Polarizability

16.33

Molar Refractivity

38.66

LOG S

0.97

Data Source

Names and Identifiers

IUPAC name

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

IUPAC Traditional name

bicine

Synonyms

BicineN,N-bis [2-hydroxyethyl]glycineDIHYDROXYETHYLGLYCINEN,N-双(2-羟乙基)甘氨酸BICINEDihydroxyethylglycineN,N-Bis(2-hydroxyethyl)glycineDiethylolglycineDiethanol glycineBICINEN,N-Bis(2-hydroxyethyl)glycinePEG Grid Screening Solution 24/Fluka kit no 36436BICINE 30% PEG 600 solution2-(bis(2-hydroxyethyl)amino)acetic acidBICINE buffer SolutionN,N-Di(2-hydroxyethyl)glycineN,N-二(2-羟乙基)甘氨酸bicine bufferN,N-bis(2-hydroxyethyl)glycineBicine

Names and Identifiers

Registration numbers

EC Number

MDL Number

CAS Number

Beilstein Number

PubChem SID

248881052484891624892086465059802489173816096680426697204