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3-Hydroxyacetaminophen

3-Hydroxyacetaminophen structure

CAS No:
37519-14-5
Formula:
C8H9NO3
Chemical Name:
3-Hydroxyacetaminophen
Synonyms:
Acetamide,N-(3,4-dihydroxyphenyl)-;Acetanilide,3′,4′-dihydroxy-;N-(3,4-Dihydroxyphenyl)acetamide;4-Acetylaminopyrocatechol;3-Hydroxyacetaminophen;4-(Acetylamino)catechol
Categories:
Organic Chemistry > Amides

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3-Hydroxyacetaminophen Basic Attributes

Molecular Weight：

167.16200

Exact Mass：

167.16

UNII：

IX22A3NJLN

DSSTox ID：

DTXSID50190960

HScode：

2924299090

Characteristics

PSA：

69.56000

XLogP3：

1.12920

Density：

1.4g/cm3

Melting Point：

170-172ºC

Boiling Point：

444.7ºC at 760 mmHg

Flash Point：

222.8ºC

Refractive Index：

1.664

Drug Information

Metabolism/Metabolites：

3-Hydroxyacetaminophen is a known human metabolite of acetaminophen.

MeSH Entry Terms：

3-hydroxyacetaminophen

Computed Properties

Molecular Weight:167.16
XLogP3:1.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:167.058243149
Monoisotopic Mass:167.058243149
Topological Polar Surface Area:69.6
Heavy Atom Count:12
Complexity:172
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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N-(3,4-Dihydroxyphenyl)acetamide

CAS No.: 37519-14-5

Content: 99.00%

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