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p-Hydroxybenzoylcholine

p-Hydroxybenzoylcholine structure

CAS No:
5094-31-5
Formula:
C12H18NO3
Chemical Name:
p-Hydroxybenzoylcholine
Synonyms:
Ethanaminium,2-[(4-hydroxybenzoyl)oxy]-N,N,N-trimethyl-;Choline,p-hydroxybenzoate (ester);2-[(4-Hydroxybenzoyl)oxy]-N,N,N-trimethylethanaminium;p-Hydroxybenzoylcholine;4-Hydroxybenzoylcholine
Categories:
Organic Chemistry > Amides

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Description

(4-Hydroxybenzoyl)choline is a 4-hydroxybenzoate ester.

p-Hydroxybenzoylcholine Basic Attributes

Molecular Weight：

224.28

Exact Mass：

224.129

DSSTox ID：

DTXSID40198970

Characteristics

PSA：

46.5

XLogP3：

2.2

Drug Information

MeSH Entry Terms：

4-hydroxybenzoylcholine

Computed Properties

Molecular Weight:224.28
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:224.12866844
Monoisotopic Mass:224.12866844
Topological Polar Surface Area:46.5
Heavy Atom Count:16
Formal Charge:1
Complexity:227
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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