O-Phosphorylethanolamine

CAT: 0862-GV2342-5gSize: 5 gDry Ice: NoHazardous: Yes

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CAT#:0862-GV2342-5gSize:5 g

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CAS Number

1071-23-4

EC Number

213-988-5

UN Code

3261

MDL Number

MFCD00008178

HS Code

29221985

Purity

98.00%

Molecular Formula

C2H8NO4P

Molecular Weight

141.06

Storage Conditions

-20°C

Hazardous Class

True

Chemical Information

Phosphoethanolamine

O-phosphoethanolamine is the ethanolamine mono-ester of phosphoric acid, and a metabolite of phospholipid metabolism. This phosphomonoester shows strong structural similarity to the inhibitory neurotransmitter GABA, and is decreased in post-mortem Alzheimer's disease brain. It has a role as a mouse metabolite, a human metabolite and an algal metabolite. It is a phosphoethanolamine and a primary amino compound. It is a conjugate acid of an O-phosphonatoethanaminium(1-).

CAS Number	1071-23-4
PubChem CID	1015
IUPAC Name	2-aminoethyl dihydrogen phosphate
Molecular Formula	C2H8NO4P
Molecular Weight	141.06
XLogP	-4.8
Topological Polar Surface Area	92.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Heavy Atom Count	8
Formal Charge	0
Complexity	98

SMILES

C(COP(=O)(O)O)N

InChI

InChI=1S/C2H8NO4P/c3-1-2-7-8(4,5)6/h1-3H2,(H2,4,5,6)

InChIKey

SUHOOTKUPISOBE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1071-23-4

CID: 1015

Formula: C2H8NO4P

MW: 141.06

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	141.06
XLogP3	-4.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	141.01909473
Monoisotopic Mass	141.01909473
Topological Polar Surface Area	92.8 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	98.2
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	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
MBS3609531-01	O-Phosphorylethanolamine
20111010-2	O-Phosphorylethanolamine Separopore® 6B
T4881	Phosphorylethanolamine
TRC-P360902-1MG	Phosphorylethanolamine-d4
sc-281522A	Cholesteryl-phosphorylethanolamine
sc-300332	Ceramide phosphorylethanolamine

O-Phosphorylethanolamine

Chemical Information

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