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2-[3-(2-hydroxypropyl)pyridin-1-ium-1-yl]acetate

2-[3-(2-hydroxypropyl)pyridin-1-ium-1-yl]acetate structure

CAS No:
119623-15-3
Formula:
C10H13NO3
Chemical Name:
2-[3-(2-hydroxypropyl)pyridin-1-ium-1-yl]acetate
Synonyms:
1-(1-carboxymethyl)-3-(2-hydroxypropyl)pyridinium betaine;CHPB;119623-15-3;CHPB;2-[3-(2-hydroxypropyl)pyridin-1-ium-1-yl]acetate;1-(1-Carboxymethyl)-3-(2-hydroxypropyl)pyridinium betaine;DTXSID90923057;[3-(2-Hydroxypropyl)pyridin-1-ium-1-yl]acetate;Pyridinium, 1-(carboxymethyl)-3-(2-hydroxypropyl)-, hydroxide, inner salt

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2-[3-(2-hydroxypropyl)pyridin-1-ium-1-yl]acetate Basic Attributes

Molecular Weight：

195.21 g/mol

Exact Mass：

195.08954328 g/mol

Characteristics

PSA：

64.2 Å²

Drug Information

MeSH Entry Terms：

1-(1-carboxymethyl)-3-(2-hydroxypropyl)pyridinium betaine

Computed Properties

Molecular Weight:195.21
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:195.08954328
Monoisotopic Mass:195.08954328
Topological Polar Surface Area:64.2
Heavy Atom Count:14
Complexity:190
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[3-(2-hydroxypropyl)pyridin-1-ium-1-yl]acetate

Basic Attributes
Characteristics
Drug Information
Computed Properties

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