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1-(3,4-dihydroxyphenyl)-2-pyridin-1-ium-1-ylethanone

1-(3,4-dihydroxyphenyl)-2-pyridin-1-ium-1-ylethanone structure

CAS No:
6623-55-8
Formula:
C13H12NO3+
Chemical Name:
1-(3,4-dihydroxyphenyl)-2-pyridin-1-ium-1-ylethanone
Synonyms:
NSC55508;6623-55-8;NSC 55508;1-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]pyridinium;CHEMBL1882079;1-(3,4-Dihydroxyphenyl)-2-(1lambda(5)-pyridin-1-yl)ethanone;ZINC1685914;NCGC00184115-01;NCGC00184115-02;NCGC00184115-03;AT-051/43410114;1-(3,4-dihydroxyphenyl)-2-pyridin-1-ium-1-yl-ethanone;1-(3,4-Dihydroxyphenyl)-2-(1.lambda.~5~-pyridin-1-yl)ethanone

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1-(3,4-dihydroxyphenyl)-2-pyridin-1-ium-1-ylethanone Basic Attributes

Molecular Weight：

230.24 g/mol

Exact Mass：

230.08171824 g/mol

Characteristics

PSA：

61.4 Å²

Computed Properties

Molecular Weight:230.24
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:230.08171824
Monoisotopic Mass:230.08171824
Topological Polar Surface Area:61.4
Heavy Atom Count:17
Formal Charge:1
Complexity:263
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(3,4-dihydroxyphenyl)-2-pyridin-1-ium-1-ylethanone

Basic Attributes
Characteristics
Computed Properties

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