Choline Hydroxide

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CAS Number

123-41-1

Synonyms

2-hydroxyethyl (trimethyl) azanium; hydroxide

MDL Number

MFCD00002831

Purity

44 wt. % in H2O

Smiles

C[N+](C)(C)CCO.[OH-]

Chemical Information

Choline, hydroxide

See also: Choline (has active moiety).

CAS Number	123-41-1
PubChem CID	31255
IUPAC Name	2-hydroxyethyl(trimethyl)azanium hydroxide
Molecular Formula	C5H15NO2
Molecular Weight	121.18
Topological Polar Surface Area	21.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	8
Formal Charge	0
Complexity	46

SMILES

C[N+](C)(C)CCO.[OH-]

InChI

InChI=1S/C5H14NO.H2O/c1-6(2,3)4-5-7;/h7H,4-5H2,1-3H3;1H2/q+1;/p-1

InChIKey

KIZQNNOULOCVDM-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 123-41-1

CID: 31255

Formula: C5H15NO2

MW: 121.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	121.18
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	121.110278721
Monoisotopic Mass	121.110278721
Topological Polar Surface Area	21.2 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	46.5
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
OR1028613	Choline
BUP19620	Choline
IN12065	Chromium Hydroxide
IN12565-01	Magnesium hydroxide
OR1030627-01	Benzyltriethylammonium Hydroxide
IN12005	Zirconium Hydroxide
BUP19354-01	Aluminum Hydroxide
OR1023652	Tetrapentylammonium Hydroxide
OR1024767	Dimethyldiethylammonium Hydroxide
BIA183336	Potassium hydroxide

Catalog	Name
267707-01	Choline hydroxide
T21537L-01	TMC647055 Choline Hydroxide Salt
444497-01	Choline Hydroxide in Methanol Solution
HY-Y1242A-01	Choline hydroxide (46% in water)
HY-Y1242-01	Choline hydroxide (44% in water)
KI-0058-HP-0500	Choline hydroxide, 15% aqueous solution
C03372-10mL	Choline hydroxide, 42.5 wt.% in water
FC15182-01	Choline hydroxide - 46 - 50 wt.% aqueous solution
0795B 00500	Choline Hydroxide, 45 Wt.% Aqueous Solution, Pure, Stabilized
TRC-C432595-50G	Choline Hydroxide in Methanol Solution (~45% w/w, stabilized with 0.5% Paraformaldehyde)