4-[(4-Hydroxypyrimidin-2-yl)amino]benzonitrile

Modify Date: 2025-09-18 18:07:39

4-[(4-Hydroxypyrimidin-2-yl)amino]benzonitrile Structure
4-[(4-Hydroxypyrimidin-2-yl)amino]benzonitrile structure
Common Name 4-[(4-Hydroxypyrimidin-2-yl)amino]benzonitrile
CAS Number 189956-45-4 Molecular Weight 212.207
Density 1.4±0.1 g/cm3 Boiling Point 482.3±51.0 °C at 760 mmHg
Molecular Formula C11H8N4O Melting Point N/A
MSDS N/A Flash Point 245.5±30.4 °C

 Names

Name 4-[(6-oxo-1H-pyrimidin-2-yl)amino]benzonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.4±0.1 g/cm3
Boiling Point 482.3±51.0 °C at 760 mmHg
Molecular Formula C11H8N4O
Molecular Weight 212.207
Flash Point 245.5±30.4 °C
Exact Mass 212.069809
PSA 81.83000
LogP 1.11
Vapour Pressure 0.0±1.3 mmHg at 25°C
Index of Refraction 1.677
InChIKey BBNOJNASJQRRSH-UHFFFAOYSA-N
SMILES N#Cc1ccc(Nc2nccc(=O)[nH]2)cc1

 Safety Information

HS Code 2933599090

 Synthetic Route

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4-[(4-Hydroxypyrimidin-2-yl)amino]benzonitrile Structure

4-[(4-Hydroxypy...

CAS#:189956-45-4

Literature: WO2012/147091 A2, ; Page/Page column 7-8 ;

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4-[(4-Hydroxypyrimidin-2-yl)amino]benzonitrile Structure

4-[(4-Hydroxypy...

CAS#:189956-45-4

Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 11, # 17 p. 2235 - 2239

 Customs

HS Code 2933599090
Summary 2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

4-[(4-Hydroxypyrimidin-2-yl)amino]benzonitrile
benzonitrile, 4-[(1,4-dihydro-4-oxo-2-pyrimidinyl)amino]-
4-[(4-Oxo-1,4-dihydro-2-pyrimidinyl)amino]benzonitrile
4-[(4-Hydroxy-pyrimidin-2-yl)amino]-benzonitrile
Benzonitrile, 4-[(4-hydroxy-2-pyrimidinyl)amino]-
4-[(4-Oxo-1,4-dihydropyrimidin-2-yl)amino]benzonitrile
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